N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]-3-methyl-benzamide

Systemtic Name: N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]-3-methyl-benzamide Openeye Name: N-[(4-chloro-3-nitro-phenyl)carbamothioyl]-3-methyl-benzamide CAS Name: N-[(4-chloro-3-nitroanilino)-sulfanylidenemethyl]-3-methylbenzamide IUPAC Name: N-[(4-chloro-3-nitrophenyl)carbamothioyl]-3-methylbenzamide Traditional Name: N-[(4-chloro-3-nitro-phenyl)thiocarbamoyl]-3-methyl-benzamide Formula: C15H12ClN3O3S MolecularWeight: 349.79208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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