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

Systemtic Name: methyl 2-cyano-3-[2-[(2-ethoxy-2-oxidanylidene-ethanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-3-oxidanylidene-propanoate Openeye Name: methyl 2-cyano-3-[2-[(2-ethoxy-2-oxo-acetyl)amino]-4,5,6,7-tetrahydrobenzothiophen-3-yl]-3-oxo-propanoate CAS Name: 2-cyano-3-[2-[(2-ethoxy-1,2-dioxoethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 2-cyano-3-[2-[(2-ethoxy-2-oxoacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-3-oxopropanoate Traditional Name: 2-cyano-3-[2-(ethoxalylamino)-4,5,6,7-tetrahydrobenzothiophen-3-yl]-3-keto-propionic acid methyl ester Formula: C17H18N2O6S MolecularWeight: 378.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)C(C#N)C(=O)OC

Isomeric SMILES

CCOC(=O)C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)C(C#N)C(=O)OC

InChI

InChI=1S/C17H18N2O6S/c1-3-25-17(23)14(21)19-15-12(9-6-4-5-7-11(9)26-15)13(20)10(8-18)16(22)24-2/h10H,3-7H2,1-2H3,(H,19,21)