[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone hydrochloride

Systemtic Name: [4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone hydrochloride Openeye Name: [4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone hydrochloride CAS Name: [4-[2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]-[3-(1-pyrrolidinylsulfonyl)phenyl]methanone hydrochloride IUPAC Name: [4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]-(3-pyrrolidin-1-ylsulfonylphenyl)methanone hydrochloride Traditional Name: [4-(2-pyrrolidinoethyl)piperazino]-(3-pyrrolidinosulfonylphenyl)methanone hydrochloride Formula: C21H33ClN4O3S MolecularWeight: 457.02972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCN2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4.Cl

Isomeric SMILES

C1CCN(C1)CCN2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4.Cl

InChI

InChI=1S/C21H32N4O3S.ClH/c26-21(24-16-14-23(15-17-24)13-12-22-8-1-2-9-22)19-6-5-7-20(18-19)29(27,28)25-10-3-4-11-25;/h5-7,18H,1-4,8-17H2;1H