ethyl 5-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[[4-(1,3-dioxoisoindolin-2-yl)benzoyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[[4-(1,3-dioxo-2-isoindolyl)phenyl]-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[[4-(1,3-dioxoisoindol-2-yl)benzoyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[(4-phthalimidobenzoyl)amino]thiophene-2-carboxylic acid ethyl ester Formula: C24H17N3O5S MolecularWeight: 459.47388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)C#N)C

InChI

InChI=1S/C24H17N3O5S/c1-3-32-24(31)19-13(2)18(12-25)21(33-19)26-20(28)14-8-10-15(11-9-14)27-22(29)16-6-4-5-7-17(16)23(27)30/h4-11H,3H2,1-2H3,(H,26,28)