3EH

3-(diethylamino)propyl (3-{[5-(3,4-dimethoxyphenyl)-2-oxo-2H-1,3,4-thiadiazin-3(6H)-yl]methyl}phenyl)carbamate


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Chemical Component Summary

Name3-(diethylamino)propyl (3-{[5-(3,4-dimethoxyphenyl)-2-oxo-2H-1,3,4-thiadiazin-3(6H)-yl]methyl}phenyl)carbamate
Identifiers3-(diethylamino)propyl N-[3-[[5-(3,4-dimethoxyphenyl)-2-oxidanylidene-6H-1,3,4-thiadiazin-3-yl]methyl]phenyl]carbamate
FormulaC26 H34 N4 O5 S
Molecular Weight514.637
TypeNON-POLYMER
Isomeric SMILESCCN(CC)CCCOC(=O)Nc1cccc(c1)CN2C(=O)SCC(=N2)c3ccc(c(c3)OC)OC
InChIInChI=1S/C26H34N4O5S/c1-5-29(6-2)13-8-14-35-25(31)27-21-10-7-9-19(15-21)17-30-26(32)36-18-22(28-30)20-11-12-23(33-3)24(16-20)34-4/h7,9-12,15-16H,5-6,8,13-14,17-18H2,1-4H3,(H,27,31)
InChIKeyWVYHFPSGWCCXMO-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count70
Chiral Atom Count0
Bond Count72
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 45258276
ChEMBL CHEMBL3402741