2-(3,4-dimethoxyphenyl)-N-[[3-(methylsulfonylamino)phenyl]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[[3-(methylsulfonylamino)phenyl]methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[[3-(methanesulfonamido)phenyl]methyl]thiazole-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[[3-(methanesulfonamido)phenyl]methyl]-4-thiazolecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[[3-(methanesulfonamido)phenyl]methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-[3-(methanesulfonamido)benzyl]thiazole-4-carboxamide Formula: C20H21N3O5S2 MolecularWeight: 447.52784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)NCC3=CC(=CC=C3)NS(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)C(=O)NCC3=CC(=CC=C3)NS(=O)(=O)C)OC

InChI

InChI=1S/C20H21N3O5S2/c1-27-17-8-7-14(10-18(17)28-2)20-22-16(12-29-20)19(24)21-11-13-5-4-6-15(9-13)23-30(3,25)26/h4-10,12,23H,11H2,1-3H3,(H,21,24)