4-(4-iodophenyl)sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-2-one hydrochloride

Systemtic Name: 4-(4-iodophenyl)sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-2-one hydrochloride Openeye Name: 4-(4-iodophenyl)sulfonyl-1-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one hydrochloride CAS Name: 4-(4-iodophenyl)sulfonyl-1-[(1-pyridin-4-yl-4-piperidinyl)methyl]-2-piperazinone hydrochloride IUPAC Name: 4-(4-iodophenyl)sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-2-one hydrochloride Traditional Name: 4-(4-iodophenyl)sulfonyl-1-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one hydrochloride Formula: C21H26ClIN4O3S MolecularWeight: 576.87861

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CCN(CC2=O)S(=O)(=O)C3=CC=C(C=C3)I)C4=CC=NC=C4.Cl

Isomeric SMILES

C1CN(CCC1CN2CCN(CC2=O)S(=O)(=O)C3=CC=C(C=C3)I)C4=CC=NC=C4.Cl

InChI

InChI=1S/C21H25IN4O3S.ClH/c22-18-1-3-20(4-2-18)30(28,29)26-14-13-25(21(27)16-26)15-17-7-11-24(12-8-17)19-5-9-23-10-6-19;/h1-6,9-10,17H,7-8,11-16H2;1H