(E)-5-[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]-3-methylsulfanyl-5-oxidanylidene-2-thiophen-3-yl-pent-2-enenitrile

Systemtic Name: (E)-5-[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]-3-methylsulfanyl-5-oxidanylidene-2-thiophen-3-yl-pent-2-enenitrile Openeye Name: (E)-5-[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]-3-methylsulfanyl-5-oxo-2-(3-thienyl)pent-2-enenitrile CAS Name: (E)-5-[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]-3-(methylthio)-5-oxo-2-(3-thiophenyl)-2-pentenenitrile IUPAC Name: (E)-5-[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]-3-methylsulfanyl-5-oxo-2-thiophen-3-ylpent-2-enenitrile Traditional Name: (E)-5-keto-5-[(1R,2R)-2-(4-methoxyphenyl)cyclopropyl]-3-(methylthio)-2-(3-thienyl)pent-2-enenitrile Formula: C20H19NO2S2 MolecularWeight: 369.50036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC2C(=O)CC(=C(C#N)C3=CSC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2C[C@H]2C(=O)C/C(=C(\C#N)/C3=CSC=C3)/SC

InChI

InChI=1S/C20H19NO2S2/c1-23-15-5-3-13(4-6-15)16-9-17(16)19(22)10-20(24-2)18(11-21)14-7-8-25-12-14/h3-8,12,16-17H,9-10H2,1-2H3/b20-18-/t16-,17+/m0/s1