N-(3-cyanothiophen-2-yl)-2-[(4-methoxyphenyl)methylamino]ethanamide; ethanedioic acid

Systemtic Name: N-(3-cyanothiophen-2-yl)-2-[(4-methoxyphenyl)methylamino]ethanamide; ethanedioic acid Openeye Name: N-(3-cyano-2-thienyl)-2-[(4-methoxyphenyl)methylamino]acetamide; oxalic acid CAS Name: N-(3-cyano-2-thiophenyl)-2-[(4-methoxyphenyl)methylamino]acetamide; oxalic acid IUPAC Name: N-(3-cyanothiophen-2-yl)-2-[(4-methoxyphenyl)methylamino]acetamide; oxalic acid Traditional Name: N-(3-cyano-2-thienyl)-2-(p-anisylamino)acetamide; oxalic acid Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNCC(=O)NC2=C(C=CS2)C#N.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)CNCC(=O)NC2=C(C=CS2)C#N.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H15N3O2S.C2H2O4/c1-20-13-4-2-11(3-5-13)9-17-10-14(19)18-15-12(8-16)6-7-21-15;3-1(4)2(5)6/h2-7,17H,9-10H2,1H3,(H,18,19);(H,3,4)(H,5,6)