cyclopropyl-[4-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]piperazin-1-yl]methanone hydrochloride

Systemtic Name: cyclopropyl-[4-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]piperazin-1-yl]methanone hydrochloride Openeye Name: cyclopropyl-[4-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidyl]piperazin-1-yl]methanone hydrochloride CAS Name: cyclopropyl-[4-[1-[(2-methylsulfonylphenyl)methyl]-4-piperidinyl]-1-piperazinyl]methanone hydrochloride IUPAC Name: cyclopropyl-[4-[1-[(2-methylsulfonylphenyl)methyl]piperidin-4-yl]piperazin-1-yl]methanone hydrochloride Traditional Name: cyclopropyl-[4-[1-(2-mesylbenzyl)-4-piperidyl]piperazino]methanone hydrochloride Formula: C21H32ClN3O3S MolecularWeight: 442.01508

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1CN2CCC(CC2)N3CCN(CC3)C(=O)C4CC4.Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1CN2CCC(CC2)N3CCN(CC3)C(=O)C4CC4.Cl

InChI

InChI=1S/C21H31N3O3S.ClH/c1-28(26,27)20-5-3-2-4-18(20)16-22-10-8-19(9-11-22)23-12-14-24(15-13-23)21(25)17-6-7-17;/h2-5,17,19H,6-16H2,1H3;1H