methyl 4-cyano-3-methyl-5-[(3-nitrophenyl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-3-methyl-5-[(3-nitrophenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 4-cyano-3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[(3-nitrophenyl)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C15H11N3O5S MolecularWeight: 345.32994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C15H11N3O5S/c1-8-11(7-16)14(24-12(8)15(20)23-2)17-13(19)9-4-3-5-10(6-9)18(21)22/h3-6H,1-2H3,(H,17,19)