[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(1-pyridin-3-ylsulfonylpiperidin-4-yl)methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(1-pyridin-3-ylsulfonylpiperidin-4-yl)methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-[1-(3-pyridylsulfonyl)-4-piperidyl]methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-[1-(3-pyridinylsulfonyl)-4-piperidinyl]methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-(1-pyridin-3-ylsulfonylpiperidin-4-yl)methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-[1-(3-pyridylsulfonyl)-4-piperidyl]methanone Formula: C22H27ClN4O3S MolecularWeight: 462.99278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H27ClN4O3S/c1-17-4-5-19(23)15-21(17)25-11-13-26(14-12-25)22(28)18-6-9-27(10-7-18)31(29,30)20-3-2-8-24-16-20/h2-5,8,15-16,18H,6-7,9-14H2,1H3