methyl (2Z,4E,6Z)-7-cyclohexyl-6-(dimethylcarbamoylsulfanyl)hepta-2,4,6-trienoate

Systemtic Name: methyl (2Z,4E,6Z)-7-cyclohexyl-6-(dimethylcarbamoylsulfanyl)hepta-2,4,6-trienoate Openeye Name: methyl (2Z,4E,6Z)-7-cyclohexyl-6-(dimethylcarbamoylsulfanyl)hepta-2,4,6-trienoate CAS Name: (2Z,4E,6Z)-7-cyclohexyl-6-[[dimethylamino(oxo)methyl]thio]hepta-2,4,6-trienoic acid methyl ester IUPAC Name: methyl (2Z,4E,6Z)-7-cyclohexyl-6-(dimethylcarbamoylsulfanyl)hepta-2,4,6-trienoate Traditional Name: (2Z,4E,6Z)-7-cyclohexyl-6-(dimethylcarbamoylthio)hepta-2,4,6-trienoic acid methyl ester Formula: C17H25NO3S MolecularWeight: 323.4503

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)SC(=CC1CCCCC1)C=CC=CC(=O)OC

Isomeric SMILES

CN(C)C(=O)S/C(=C\C1CCCCC1)/C=C/C=C\C(=O)OC

InChI

InChI=1S/C17H25NO3S/c1-18(2)17(20)22-15(11-7-8-12-16(19)21-3)13-14-9-5-4-6-10-14/h7-8,11-14H,4-6,9-10H2,1-3H3/b11-7+,12-8-,15-13-