5-azanyl-N-[(4-chlorophenyl)carbamoyl]-4-cyano-3-(3-nitrophenyl)thiophene-2-carboxamide

Systemtic Name: 5-azanyl-N-[(4-chlorophenyl)carbamoyl]-4-cyano-3-(3-nitrophenyl)thiophene-2-carboxamide Openeye Name: 5-amino-N-[(4-chlorophenyl)carbamoyl]-4-cyano-3-(3-nitrophenyl)thiophene-2-carboxamide CAS Name: 5-amino-N-[(4-chloroanilino)-oxomethyl]-4-cyano-3-(3-nitrophenyl)-2-thiophenecarboxamide IUPAC Name: 5-amino-N-[(4-chlorophenyl)carbamoyl]-4-cyano-3-(3-nitrophenyl)thiophene-2-carboxamide Traditional Name: 5-amino-N-[(4-chlorophenyl)carbamoyl]-4-cyano-3-(3-nitrophenyl)thiophene-2-carboxamide Formula: C19H12ClN5O4S MolecularWeight: 441.84768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C(SC(=C2C#N)N)C(=O)NC(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C(SC(=C2C#N)N)C(=O)NC(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H12ClN5O4S/c20-11-4-6-12(7-5-11)23-19(27)24-18(26)16-15(14(9-21)17(22)30-16)10-2-1-3-13(8-10)25(28)29/h1-8H,22H2,(H2,23,24,26,27)