2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]ethanamide

Systemtic Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]ethanamide Openeye Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-[(2-phenylthiazol-4-yl)methyl]acetamide CAS Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-[(2-phenyl-4-thiazolyl)methyl]acetamide IUPAC Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]-N-[(2-phenylthiazol-4-yl)methyl]acetamide Formula: C21H22N4O4S2 MolecularWeight: 458.55378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NCC2=CSC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NCC2=CSC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O4S2/c1-15(26)23-17-8-10-19(11-9-17)31(28,29)25(2)13-20(27)22-12-18-14-30-21(24-18)16-6-4-3-5-7-16/h3-11,14H,12-13H2,1-2H3,(H,22,27)(H,23,26)