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

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-(1-methylsulfonylpiperidin-3-yl)methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-(1-methylsulfonyl-3-piperidyl)methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-(1-methylsulfonyl-3-piperidinyl)methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-(1-methylsulfonylpiperidin-3-yl)methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-(1-mesyl-3-piperidyl)methanone Formula: C18H26ClN3O3S MolecularWeight: 399.93534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C

InChI

InChI=1S/C18H26ClN3O3S/c1-14-5-6-16(19)12-17(14)20-8-10-21(11-9-20)18(23)15-4-3-7-22(13-15)26(2,24)25/h5-6,12,15H,3-4,7-11,13H2,1-2H3