[4-(3-methylphenyl)piperazin-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone

Systemtic Name: [4-(3-methylphenyl)piperazin-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone Openeye Name: [4-(m-tolyl)piperazin-1-yl]-[3-(1-piperidylsulfonyl)-2-thienyl]methanone CAS Name: [4-(3-methylphenyl)-1-piperazinyl]-[3-(1-piperidinylsulfonyl)-2-thiophenyl]methanone IUPAC Name: [4-(3-methylphenyl)piperazin-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone Traditional Name: [4-(m-tolyl)piperazino]-(3-piperidinosulfonyl-2-thienyl)methanone Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H27N3O3S2/c1-17-6-5-7-18(16-17)22-11-13-23(14-12-22)21(25)20-19(8-15-28-20)29(26,27)24-9-3-2-4-10-24/h5-8,15-16H,2-4,9-14H2,1H3