N-[4-(4-methoxy-3-methyl-phenyl)-1,3-thiazol-2-yl]-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-[4-(4-methoxy-3-methyl-phenyl)-1,3-thiazol-2-yl]-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 3-benzylsulfonyl-N-[4-(4-methoxy-3-methyl-phenyl)thiazol-2-yl]propanamide CAS Name: N-[4-(4-methoxy-3-methylphenyl)-2-thiazolyl]-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 3-benzylsulfonyl-N-[4-(4-methoxy-3-methylphenyl)-1,3-thiazol-2-yl]propanamide Traditional Name: 3-benzylsulfonyl-N-[4-(4-methoxy-3-methyl-phenyl)thiazol-2-yl]propionamide Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CSC(=N2)NC(=O)CCS(=O)(=O)CC3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CSC(=N2)NC(=O)CCS(=O)(=O)CC3=CC=CC=C3)OC

InChI

InChI=1S/C21H22N2O4S2/c1-15-12-17(8-9-19(15)27-2)18-13-28-21(22-18)23-20(24)10-11-29(25,26)14-16-6-4-3-5-7-16/h3-9,12-13H,10-11,14H2,1-2H3,(H,22,23,24)