N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-methylphenyl)sulfonylamino]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-methylphenyl)sulfonylamino]-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(p-tolylsulfonylamino)thiazole-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-methylphenyl)sulfonylamino]-4-thiazolecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-methylphenyl)sulfonylamino]-1,3-thiazole-4-carboxamide Traditional Name: N-homoveratryl-2-(tosylamino)thiazole-4-carboxamide Formula: C21H23N3O5S2 MolecularWeight: 461.55442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CS2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CS2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H23N3O5S2/c1-14-4-7-16(8-5-14)31(26,27)24-21-23-17(13-30-21)20(25)22-11-10-15-6-9-18(28-2)19(12-15)29-3/h4-9,12-13H,10-11H2,1-3H3,(H,22,25)(H,23,24)