BII
2-{[5-CHLORO-2-({(1E,4R)-2-METHOXY-4-[(3R)-3-(METHYLAMINO)PYRROLIDIN-1-YL]CYCLOHEXA-2,5-DIEN-1-YLIDENE}AMINO)PYRIMIDIN-4-YL]AMINO}-N-(1-METHYLETHYL)BENZENESULFONAMIDE
Find entries where: BII
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 2-{[5-CHLORO-2-({(1E,4R)-2-METHOXY-4-[(3R)-3-(METHYLAMINO)PYRROLIDIN-1-YL]CYCLOHEXA-2,5-DIEN-1-YLIDENE}AMINO)PYRIMIDIN-4-YL]AMINO}-N-(1-METHYLETHYL)BENZENESULFONAMIDE |
Identifiers | 2-[[5-chloro-2-[[2-methoxy-4-[(3R)-3-methylaminopyrrolidin-1-yl]-1-cyclohexa-2,5-dienylidene]amino]pyrimidin-4-yl]amino]-N-propan-2-yl-benzenesulfonamide |
Formula | C25 H32 Cl N7 O3 S |
Molecular Weight | 546.085 |
Type | NON-POLYMER |
Isomeric SMILES | CC(C)NS(=O)(=O)c1ccccc1Nc2c(cnc(n2)N=C3C=CC(C=C3OC)N4CC[C@H](C4)NC)Cl |
InChI | InChI=1S/C25H32ClN7O3S/c1-16(2)32-37(34,35)23-8-6-5-7-21(23)29-24-19(26)14-28-25(31-24)30-20-10-9-18(13-22(20)36-4)33-12-11-17(15-33)27-3/h5-10,13-14,16-18,27,32H,11-12,15H2,1-4H3,(H,28,29,31)/b30-20+/t17-,18?/m1/s1 |
InChIKey | GLVPQZCTTHRANR-ZYGFWXSESA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 69 |
Chiral Atom Count | 2 |
Bond Count | 72 |
Aromatic Bond Count | 12 |
Related Resource References
Resource Name | Reference |
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PubChem | 52945394 |