methyl (2E)-2-[2-[2-(1H-imidazol-2-yl)-2-oxidanylidene-ethyl]-6,7-dihydro-4H-1-benzothiophen-5-ylidene]ethanoate

Systemtic Name: methyl (2E)-2-[2-[2-(1H-imidazol-2-yl)-2-oxidanylidene-ethyl]-6,7-dihydro-4H-1-benzothiophen-5-ylidene]ethanoate Openeye Name: methyl (2E)-2-[2-[2-(1H-imidazol-2-yl)-2-oxo-ethyl]-6,7-dihydro-4H-benzothiophen-5-ylidene]acetate CAS Name: (2E)-2-[2-[2-(1H-imidazol-2-yl)-2-oxoethyl]-6,7-dihydro-4H-1-benzothiophen-5-ylidene]acetic acid methyl ester IUPAC Name: methyl (2E)-2-[2-[2-(1H-imidazol-2-yl)-2-oxoethyl]-6,7-dihydro-4H-1-benzothiophen-5-ylidene]acetate Traditional Name: (2E)-2-[2-[2-(1H-imidazol-2-yl)-2-keto-ethyl]-6,7-dihydro-4H-benzothiophen-5-ylidene]acetic acid methyl ester Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C1CCC2=C(C1)C=C(S2)CC(=O)C3=NC=CN3

Isomeric SMILES

COC(=O)/C=C/1\CCC2=C(C1)C=C(S2)CC(=O)C3=NC=CN3

InChI

InChI=1S/C16H16N2O3S/c1-21-15(20)7-10-2-3-14-11(6-10)8-12(22-14)9-13(19)16-17-4-5-18-16/h4-5,7-8H,2-3,6,9H2,1H3,(H,17,18)/b10-7+