N-[(E)-3-[(2-methylphenyl)amino]-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(E)-3-[(2-methylphenyl)amino]-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]thiophene-2-carboxamide Openeye Name: N-[(E)-2-(3-nitrophenyl)-1-(o-tolylcarbamoyl)vinyl]thiophene-2-carboxamide CAS Name: N-[(E)-3-(2-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(E)-3-(2-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide Traditional Name: N-[(E)-2-(3-nitrophenyl)-1-(o-tolylcarbamoyl)vinyl]thiophene-2-carboxamide Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(=CC2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H17N3O4S/c1-14-6-2-3-9-17(14)22-20(25)18(23-21(26)19-10-5-11-29-19)13-15-7-4-8-16(12-15)24(27)28/h2-13H,1H3,(H,22,25)(H,23,26)/b18-13+