3-chloranyl-1-(1-methylpiperidin-4-yl)sulfanyl-isoquinoline

Systemtic Name: 3-chloranyl-1-(1-methylpiperidin-4-yl)sulfanyl-isoquinoline Openeye Name: 3-chloro-1-[(1-methyl-4-piperidyl)sulfanyl]isoquinoline CAS Name: 3-chloro-1-[(1-methyl-4-piperidinyl)thio]isoquinoline IUPAC Name: 3-chloro-1-(1-methylpiperidin-4-yl)sulfanylisoquinoline Traditional Name: 3-chloro-1-[(1-methyl-4-piperidyl)thio]isoquinoline Formula: C15H17ClN2S MolecularWeight: 292.82688

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)SC2=NC(=CC3=CC=CC=C32)Cl

Isomeric SMILES

CN1CCC(CC1)SC2=NC(=CC3=CC=CC=C32)Cl

InChI

InChI=1S/C15H17ClN2S/c1-18-8-6-12(7-9-18)19-15-13-5-3-2-4-11(13)10-14(16)17-15/h2-5,10,12H,6-9H2,1H3