N-[(3-nitrophenyl)carbamothioyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[(3-nitrophenyl)carbamothioyl]-2,2-diphenyl-ethanamide Openeye Name: N-[(3-nitrophenyl)carbamothioyl]-2,2-diphenyl-acetamide CAS Name: N-[(3-nitroanilino)-sulfanylidenemethyl]-2,2-diphenylacetamide IUPAC Name: N-[(3-nitrophenyl)carbamothioyl]-2,2-diphenylacetamide Traditional Name: N-[(3-nitrophenyl)thiocarbamoyl]-2,2-diphenyl-acetamide Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O3S/c25-20(23-21(28)22-17-12-7-13-18(14-17)24(26)27)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-14,19H,(H2,22,23,25,28)