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

Systemtic Name: N-(1-cyclopropylcarbonylpiperidin-4-yl)-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-[1-(cyclopropanecarbonyl)-4-piperidyl]-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-[1-[cyclopropyl(oxo)methyl]-4-piperidinyl]-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-[1-(cyclopropanecarbonyl)-4-piperidyl]-4-(methylthio)-2-(tosylamino)butyramide Formula: C21H31N3O4S2 MolecularWeight: 453.61854

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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)C3CC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NC2CCN(CC2)C(=O)C3CC3

InChI

InChI=1S/C21H31N3O4S2/c1-15-3-7-18(8-4-15)30(27,28)23-19(11-14-29-2)20(25)22-17-9-12-24(13-10-17)21(26)16-5-6-16/h3-4,7-8,16-17,19,23H,5-6,9-14H2,1-2H3,(H,22,25)