N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: 1-methylsulfonyl-N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-mesyl-N-[3-[4-(m-tolyl)piperazino]propyl]-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C25H34N4O3S MolecularWeight: 470.62746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C

InChI

InChI=1S/C25H34N4O3S/c1-20-6-3-8-23(18-20)28-16-14-27(15-17-28)12-5-11-26-25(30)22-9-10-24-21(19-22)7-4-13-29(24)33(2,31)32/h3,6,8-10,18-19H,4-5,7,11-17H2,1-2H3,(H,26,30)