4-chloranyl-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-chloranyl-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 4-chloro-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]benzamide CAS Name: 4-chloro-N-[(2-methyl-5-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[(2-methyl-5-nitrophenyl)carbamothioyl]benzamide Traditional Name: 4-chloro-N-[(2-methyl-5-nitro-phenyl)thiocarbamoyl]benzamide Formula: C15H12ClN3O3S MolecularWeight: 349.79208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClN3O3S/c1-9-2-7-12(19(21)22)8-13(9)17-15(23)18-14(20)10-3-5-11(16)6-4-10/h2-8H,1H3,(H2,17,18,20,23)