2-[(4-methylphenyl)-methylsulfonyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)butanamide

Systemtic Name: 2-[(4-methylphenyl)-methylsulfonyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)butanamide Openeye Name: 2-(4-methyl-N-methylsulfonyl-anilino)-N-[4-(1-piperidylsulfonyl)phenyl]butanamide CAS Name: 2-(4-methyl-N-methylsulfonylanilino)-N-[4-(1-piperidinylsulfonyl)phenyl]butanamide IUPAC Name: 2-(4-methyl-N-methylsulfonylanilino)-N-(4-piperidin-1-ylsulfonylphenyl)butanamide Traditional Name: 2-(N-mesyl-4-methyl-anilino)-N-(4-piperidinosulfonylphenyl)butyramide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)N(C3=CC=C(C=C3)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)N(C3=CC=C(C=C3)C)S(=O)(=O)C

InChI

InChI=1S/C23H31N3O5S2/c1-4-22(26(32(3,28)29)20-12-8-18(2)9-13-20)23(27)24-19-10-14-21(15-11-19)33(30,31)25-16-6-5-7-17-25/h8-15,22H,4-7,16-17H2,1-3H3,(H,24,27)