N-[(5-chloranyl-2-methyl-4-nitro-phenyl)carbamothioyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[(5-chloranyl-2-methyl-4-nitro-phenyl)carbamothioyl]-2,2-diphenyl-ethanamide Openeye Name: N-[(5-chloro-2-methyl-4-nitro-phenyl)carbamothioyl]-2,2-diphenyl-acetamide CAS Name: N-[(5-chloro-2-methyl-4-nitroanilino)-sulfanylidenemethyl]-2,2-diphenylacetamide IUPAC Name: N-[(5-chloro-2-methyl-4-nitrophenyl)carbamothioyl]-2,2-diphenylacetamide Traditional Name: N-[(5-chloro-2-methyl-4-nitro-phenyl)thiocarbamoyl]-2,2-diphenyl-acetamide Formula: C22H18ClN3O3S MolecularWeight: 439.91462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClN3O3S/c1-14-12-19(26(28)29)17(23)13-18(14)24-22(30)25-21(27)20(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-13,20H,1H3,(H2,24,25,27,30)