3,5-dimethyl-N-[(4-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 3,5-dimethyl-N-[(4-nitrophenyl)carbamothioyl]benzamide Openeye Name: 3,5-dimethyl-N-[(4-nitrophenyl)carbamothioyl]benzamide CAS Name: 3,5-dimethyl-N-[(4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dimethyl-N-[(4-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3,5-dimethyl-N-[(4-nitrophenyl)thiocarbamoyl]benzamide Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H15N3O3S/c1-10-7-11(2)9-12(8-10)15(20)18-16(23)17-13-3-5-14(6-4-13)19(21)22/h3-9H,1-2H3,(H2,17,18,20,23)