[2-[ethanoyl-(2-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl 5-nitrothiophene-2-carboxylate

Systemtic Name: [2-[ethanoyl-(2-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl 5-nitrothiophene-2-carboxylate Openeye Name: [2-(N-acetyl-2-methoxy-anilino)thiazol-4-yl]methyl 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid [2-(N-acetyl-2-methoxyanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2-methoxyanilino)-1,3-thiazol-4-yl]methyl 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid [2-(N-acetyl-2-methoxy-anilino)thiazol-4-yl]methyl ester Formula: C18H15N3O6S2 MolecularWeight: 433.4582

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1OC)C2=NC(=CS2)COC(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1OC)C2=NC(=CS2)COC(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O6S2/c1-11(22)20(13-5-3-4-6-14(13)26-2)18-19-12(10-28-18)9-27-17(23)15-7-8-16(29-15)21(24)25/h3-8,10H,9H2,1-2H3