N-[(2-methyl-5-nitro-phenyl)carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[(2-methyl-5-nitro-phenyl)carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[(2-methyl-5-nitro-phenyl)carbamothioyl]-2-phenyl-acetamide CAS Name: N-[(2-methyl-5-nitroanilino)-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[(2-methyl-5-nitrophenyl)carbamothioyl]-2-phenylacetamide Traditional Name: N-[(2-methyl-5-nitro-phenyl)thiocarbamoyl]-2-phenyl-acetamide Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C16H15N3O3S/c1-11-7-8-13(19(21)22)10-14(11)17-16(23)18-15(20)9-12-5-3-2-4-6-12/h2-8,10H,9H2,1H3,(H2,17,18,20,23)