4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-[(3-nitrophenyl)carbonylamino]thiophene-2-carboxamide

Systemtic Name: 4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-[(3-nitrophenyl)carbonylamino]thiophene-2-carboxamide Openeye Name: 4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2-carboxamide CAS Name: 4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-[[(3-nitrophenyl)-oxomethyl]amino]-2-thiophenecarboxamide IUPAC Name: 4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2-carboxamide Traditional Name: 4-cyano-N-(2,3-dimethylphenyl)-3-methyl-5-[(3-nitrobenzoyl)amino]thiophene-2-carboxamide Formula: C22H18N4O4S MolecularWeight: 434.46772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=C(C(=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C#N)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=C(C(=C(S2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C#N)C)C

InChI

InChI=1S/C22H18N4O4S/c1-12-6-4-9-18(13(12)2)24-21(28)19-14(3)17(11-23)22(31-19)25-20(27)15-7-5-8-16(10-15)26(29)30/h4-10H,1-3H3,(H,24,28)(H,25,27)