0ST
1-[3-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-yl]-3-[2-(morpholin-4-yl)ethyl]urea
Find entries where: 0ST
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 1-[3-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-yl]-3-[2-(morpholin-4-yl)ethyl]urea |
Identifiers | 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-(2-morpholin-4-ylethyl)urea |
Formula | C21 H31 N5 O2 |
Molecular Weight | 385.503 |
Type | NON-POLYMER |
Isomeric SMILES | Cc1ccc(cc1)n2c(cc(n2)C(C)(C)C)NC(=O)NCCN3CCOCC3 |
InChI | InChI=1S/C21H31N5O2/c1-16-5-7-17(8-6-16)26-19(15-18(24-26)21(2,3)4)23-20(27)22-9-10-25-11-13-28-14-12-25/h5-8,15H,9-14H2,1-4H3,(H2,22,23,27) |
InChIKey | WTTXDKWUUKCBRY-UHFFFAOYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 59 |
Chiral Atom Count | 0 |
Bond Count | 61 |
Aromatic Bond Count | 11 |
Related Resource References
Resource Name | Reference |
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PubChem | 71305043 |
ChEMBL | CHEMBL3401550 |