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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

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