methyl 4-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-4-oxo-butanoate CAS Name: 4-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-4-oxobutanoate Traditional Name: 4-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-4-keto-butyric acid methyl ester Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)NC1=C(C2=C(S1)CCCC2)C#N

Isomeric SMILES

COC(=O)CCC(=O)NC1=C(C2=C(S1)CCCC2)C#N

InChI

InChI=1S/C14H16N2O3S/c1-19-13(18)7-6-12(17)16-14-10(8-15)9-4-2-3-5-11(9)20-14/h2-7H2,1H3,(H,16,17)