(2E,4E)-5-(phenylmethylsulfanyl)-1-piperidin-1-yl-penta-2,4-dien-1-one

Systemtic Name: (2E,4E)-5-(phenylmethylsulfanyl)-1-piperidin-1-yl-penta-2,4-dien-1-one Openeye Name: (2E,4E)-5-benzylsulfanyl-1-(1-piperidyl)penta-2,4-dien-1-one CAS Name: (2E,4E)-5-(phenylmethylthio)-1-(1-piperidinyl)-1-penta-2,4-dienone IUPAC Name: (2E,4E)-5-benzylsulfanyl-1-piperidin-1-ylpenta-2,4-dien-1-one Traditional Name: (2E,4E)-5-(benzylthio)-1-piperidino-penta-2,4-dien-1-one Formula: C17H21NOS MolecularWeight: 287.41974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C=CC=CSCC2=CC=CC=C2

Isomeric SMILES

C1CCN(CC1)C(=O)/C=C/C=C/SCC2=CC=CC=C2

InChI

InChI=1S/C17H21NOS/c19-17(18-12-6-2-7-13-18)11-5-8-14-20-15-16-9-3-1-4-10-16/h1,3-5,8-11,14H,2,6-7,12-13,15H2/b11-5+,14-8+