3-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(phenylcarbamoyl)propanamide

Systemtic Name: 3-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(phenylcarbamoyl)propanamide Openeye Name: 3-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(phenylcarbamoyl)propanamide CAS Name: N-[anilino(oxo)methyl]-3-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: 3-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(phenylcarbamoyl)propanamide Traditional Name: 3-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-N-(phenylcarbamoyl)propionamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CCC(=O)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CCC(=O)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O4S/c1-17-8-9-18(2)20(16-17)31(29,30)26-14-12-25(13-15-26)11-10-21(27)24-22(28)23-19-6-4-3-5-7-19/h3-9,16H,10-15H2,1-2H3,(H2,23,24,27,28)