2-[1-(phenylmethyl)piperidin-4-yl]sulfanylquinoline

Systemtic Name: 2-[1-(phenylmethyl)piperidin-4-yl]sulfanylquinoline Openeye Name: 2-[(1-benzyl-4-piperidyl)sulfanyl]quinoline CAS Name: 2-[[1-(phenylmethyl)-4-piperidinyl]thio]quinoline IUPAC Name: 2-(1-benzylpiperidin-4-yl)sulfanylquinoline Traditional Name: 2-[(1-benzyl-4-piperidyl)thio]quinoline Formula: C21H22N2S MolecularWeight: 334.47778

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1SC2=NC3=CC=CC=C3C=C2)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1SC2=NC3=CC=CC=C3C=C2)CC4=CC=CC=C4

InChI

InChI=1S/C21H22N2S/c1-2-6-17(7-3-1)16-23-14-12-19(13-15-23)24-21-11-10-18-8-4-5-9-20(18)22-21/h1-11,19H,12-16H2