3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-(thiophen-2-ylmethyl)propanamide

Systemtic Name: 3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-(thiophen-2-ylmethyl)propanamide Openeye Name: 3-[4-methyl-N-(p-tolylsulfonyl)anilino]-N-(2-thienylmethyl)propanamide CAS Name: 3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: 3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)-N-(thiophen-2-ylmethyl)propanamide Traditional Name: 3-(4-methyl-N-tosyl-anilino)-N-(2-thenyl)propionamide Formula: C22H24N2O3S2 MolecularWeight: 428.56756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC(=O)NCC2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC(=O)NCC2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H24N2O3S2/c1-17-5-9-19(10-6-17)24(29(26,27)21-11-7-18(2)8-12-21)14-13-22(25)23-16-20-4-3-15-28-20/h3-12,15H,13-14,16H2,1-2H3,(H,23,25)