N-(1-ethanoylpiperidin-4-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-(1-ethanoylpiperidin-4-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-(1-acetyl-4-piperidyl)-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-(1-acetyl-4-piperidinyl)-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-(1-acetylpiperidin-4-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-(1-acetyl-4-piperidyl)-4-(methylthio)-2-(tosylamino)butyramide Formula: C19H29N3O4S2 MolecularWeight: 427.58126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2CCN(CC2)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2CCN(CC2)C(=O)C

InChI

InChI=1S/C19H29N3O4S2/c1-14-4-6-17(7-5-14)28(25,26)21-18(10-13-27-3)19(24)20-16-8-11-22(12-9-16)15(2)23/h4-7,16,18,21H,8-13H2,1-3H3,(H,20,24)