1-[(1R,2S)-2-[(2Z,4E)-5-phenylsulfanylpenta-2,4-dien-2-yl]cyclohexyl]but-3-en-2-one

Systemtic Name: 1-[(1R,2S)-2-[(2Z,4E)-5-phenylsulfanylpenta-2,4-dien-2-yl]cyclohexyl]but-3-en-2-one Openeye Name: 1-[(1R,2S)-2-[(1Z,3E)-1-methyl-4-phenylsulfanyl-buta-1,3-dienyl]cyclohexyl]but-3-en-2-one CAS Name: 1-[(1R,2S)-2-[(2Z,4E)-5-(phenylthio)penta-2,4-dien-2-yl]cyclohexyl]-3-buten-2-one IUPAC Name: 1-[(1R,2S)-2-[(2Z,4E)-5-phenylsulfanylpenta-2,4-dien-2-yl]cyclohexyl]but-3-en-2-one Traditional Name: 1-[(1R,2S)-2-[(1Z,3E)-1-methyl-4-(phenylthio)buta-1,3-dienyl]cyclohexyl]but-3-en-2-one Formula: C21H26OS MolecularWeight: 326.49554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=CSC1=CC=CC=C1)C2CCCCC2CC(=O)C=C

Isomeric SMILES

C/C(=C/C=C/SC1=CC=CC=C1)/[C@H]2CCCC[C@@H]2CC(=O)C=C

InChI

InChI=1S/C21H26OS/c1-3-19(22)16-18-11-7-8-14-21(18)17(2)10-9-15-23-20-12-5-4-6-13-20/h3-6,9-10,12-13,15,18,21H,1,7-8,11,14,16H2,2H3/b15-9+,17-10-/t18-,21-/m1/s1