methyl 5-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-[(2-chloro-5-nitro-benzoyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(2-chloro-5-nitrobenzoyl)amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[(2-chloro-5-nitro-benzoyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C15H10ClN3O5S MolecularWeight: 379.775

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10ClN3O5S/c1-7-10(6-17)14(25-12(7)15(21)24-2)18-13(20)9-5-8(19(22)23)3-4-11(9)16/h3-5H,1-2H3,(H,18,20)