S-[(3Z)-3-(phenylmethylidene)piperidin-4-yl] ethanethioate hydrochloride

Systemtic Name: S-[(3Z)-3-(phenylmethylidene)piperidin-4-yl] ethanethioate hydrochloride Openeye Name: S-[(3Z)-3-benzylidene-4-piperidyl] ethanethioate hydrochloride CAS Name: ethanethioic acid S-[(3Z)-3-(phenylmethylene)-4-piperidinyl] ester hydrochloride IUPAC Name: S-[(3Z)-3-benzylidenepiperidin-4-yl] ethanethioate hydrochloride Traditional Name: ethanethioic acid S-[(3Z)-3-benzal-4-piperidyl] ester hydrochloride Formula: C14H18ClNOS MolecularWeight: 283.81682

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CCNCC1=CC2=CC=CC=C2.Cl

Isomeric SMILES

CC(=O)SC\1CCNC/C1=C/C2=CC=CC=C2.Cl

InChI

InChI=1S/C14H17NOS.ClH/c1-11(16)17-14-7-8-15-10-13(14)9-12-5-3-2-4-6-12;/h2-6,9,14-15H,7-8,10H2,1H3;1H/b13-9-;