N-[(1Z)-2-(3,4-dimethoxyphenyl)hexa-1,5-dienyl]-2-ethylsulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: N-[(1Z)-2-(3,4-dimethoxyphenyl)hexa-1,5-dienyl]-2-ethylsulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-[(1Z)-2-(3,4-dimethoxyphenyl)hexa-1,5-dienyl]-2-ethylsulfanyl-acetamide CAS Name: N-[(1Z)-2-(3,4-dimethoxyphenyl)hexa-1,5-dienyl]-2-(ethylthio)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-[(1Z)-2-(3,4-dimethoxyphenyl)hexa-1,5-dienyl]-2-ethylsulfanylacetamide Traditional Name: N-benzyl-N-[(1Z)-2-(3,4-dimethoxyphenyl)hexa-1,5-dienyl]-2-(ethylthio)acetamide Formula: C25H31NO3S MolecularWeight: 425.58354

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC(=O)N(CC1=CC=CC=C1)C=C(CCC=C)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCSCC(=O)N(CC1=CC=CC=C1)/C=C(/CCC=C)\C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C25H31NO3S/c1-5-7-13-22(21-14-15-23(28-3)24(16-21)29-4)18-26(25(27)19-30-6-2)17-20-11-9-8-10-12-20/h5,8-12,14-16,18H,1,6-7,13,17,19H2,2-4H3/b22-18-