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

Systemtic Name: [2-[ethanoyl-(2-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl 5-nitro-1-benzothiophene-2-carboxylate Openeye Name: [2-(N-acetyl-2-methoxy-anilino)thiazol-4-yl]methyl 5-nitrobenzothiophene-2-carboxylate CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid [2-(N-acetyl-2-methoxyanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2-methoxyanilino)-1,3-thiazol-4-yl]methyl 5-nitro-1-benzothiophene-2-carboxylate Traditional Name: 5-nitrobenzothiophene-2-carboxylic acid [2-(N-acetyl-2-methoxy-anilino)thiazol-4-yl]methyl ester Formula: C22H17N3O6S2 MolecularWeight: 483.51688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1OC)C2=NC(=CS2)COC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1OC)C2=NC(=CS2)COC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O6S2/c1-13(26)24(17-5-3-4-6-18(17)30-2)22-23-15(12-32-22)11-31-21(27)20-10-14-9-16(25(28)29)7-8-19(14)33-20/h3-10,12H,11H2,1-2H3