[(E)-(1-cyano-3-methylsulfanyl-6,7-dihydro-5H-2-benzothiophen-4-ylidene)amino] ethanoate

Systemtic Name: [(E)-(1-cyano-3-methylsulfanyl-6,7-dihydro-5H-2-benzothiophen-4-ylidene)amino] ethanoate Openeye Name: [(E)-(1-cyano-3-methylsulfanyl-6,7-dihydro-5H-2-benzothiophen-4-ylidene)amino] acetate CAS Name: acetic acid [(E)-[1-cyano-3-(methylthio)-6,7-dihydro-5H-2-benzothiophen-4-ylidene]amino] ester IUPAC Name: [(E)-(1-cyano-3-methylsulfanyl-6,7-dihydro-5H-2-benzothiophen-4-ylidene)amino] acetate Traditional Name: acetic acid [(E)-[1-cyano-3-(methylthio)-6,7-dihydro-5H-isobenzothiophen-4-ylidene]amino] ester Formula: C12H12N2O2S2 MolecularWeight: 280.36588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON=C1CCCC2=C(SC(=C21)SC)C#N

Isomeric SMILES

CC(=O)O/N=C/1\CCCC2=C(SC(=C21)SC)C#N

InChI

InChI=1S/C12H12N2O2S2/c1-7(15)16-14-9-5-3-4-8-10(6-13)18-12(17-2)11(8)9/h3-5H2,1-2H3/b14-9+