N-[(4-chloranyl-2-nitro-phenyl)carbamothioyl]-2,4-dimethyl-benzamide

Systemtic Name: N-[(4-chloranyl-2-nitro-phenyl)carbamothioyl]-2,4-dimethyl-benzamide Openeye Name: N-[(4-chloro-2-nitro-phenyl)carbamothioyl]-2,4-dimethyl-benzamide CAS Name: N-[(4-chloro-2-nitroanilino)-sulfanylidenemethyl]-2,4-dimethylbenzamide IUPAC Name: N-[(4-chloro-2-nitrophenyl)carbamothioyl]-2,4-dimethylbenzamide Traditional Name: N-[(4-chloro-2-nitro-phenyl)thiocarbamoyl]-2,4-dimethyl-benzamide Formula: C16H14ClN3O3S MolecularWeight: 363.81866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN3O3S/c1-9-3-5-12(10(2)7-9)15(21)19-16(24)18-13-6-4-11(17)8-14(13)20(22)23/h3-8H,1-2H3,(H2,18,19,21,24)