2-azanyl-1-[4-(1-methylpiperidin-4-yl)-2-pyridin-2-yl-piperidin-1-yl]-3-sulfanyl-propan-1-one hydrochloride

Systemtic Name: 2-azanyl-1-[4-(1-methylpiperidin-4-yl)-2-pyridin-2-yl-piperidin-1-yl]-3-sulfanyl-propan-1-one hydrochloride Openeye Name: 2-amino-1-[4-(1-methyl-4-piperidyl)-2-(2-pyridyl)-1-piperidyl]-3-sulfanyl-propan-1-one hydrochloride CAS Name: 2-amino-3-mercapto-1-[4-(1-methyl-4-piperidinyl)-2-(2-pyridinyl)-1-piperidinyl]-1-propanone hydrochloride IUPAC Name: 2-amino-1-[4-(1-methylpiperidin-4-yl)-2-pyridin-2-ylpiperidin-1-yl]-3-sulfanylpropan-1-one hydrochloride Traditional Name: 2-amino-3-mercapto-1-[4-(1-methyl-4-piperidyl)-2-(2-pyridyl)piperidino]propan-1-one hydrochloride Formula: C19H31ClN4OS MolecularWeight: 398.99364

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2CCN(C(C2)C3=CC=CC=N3)C(=O)C(CS)N.Cl

Isomeric SMILES

CN1CCC(CC1)C2CCN(C(C2)C3=CC=CC=N3)C(=O)C(CS)N.Cl

InChI

InChI=1S/C19H30N4OS.ClH/c1-22-9-5-14(6-10-22)15-7-11-23(19(24)16(20)13-25)18(12-15)17-4-2-3-8-21-17;/h2-4,8,14-16,18,25H,5-7,9-13,20H2,1H3;1H