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

Systemtic Name: ethyl 5-azanyl-3-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbonyloxymethyl]-4-cyano-thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[4-(1,3-dioxoisoindolin-2-yl)benzoyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[4-(1,3-dioxo-2-isoindolyl)phenyl]-oxomethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[4-(1,3-dioxoisoindol-2-yl)benzoyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(4-phthalimidobenzoyl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C24H17N3O6S MolecularWeight: 475.47328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H17N3O6S/c1-2-32-24(31)19-18(17(11-25)20(26)34-19)12-33-23(30)13-7-9-14(10-8-13)27-21(28)15-5-3-4-6-16(15)22(27)29/h3-10H,2,12,26H2,1H3