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

Systemtic Name: 4-chloranyl-N-[(3-chloranyl-4-methyl-phenyl)carbamothioyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(3-chloro-4-methyl-phenyl)carbamothioyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(3-chloro-4-methylanilino)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(3-chloro-4-methylphenyl)carbamothioyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(3-chloro-4-methyl-phenyl)thiocarbamoyl]-3-nitro-benzamide Formula: C15H11Cl2N3O3S MolecularWeight: 384.23714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11Cl2N3O3S/c1-8-2-4-10(7-12(8)17)18-15(24)19-14(21)9-3-5-11(16)13(6-9)20(22)23/h2-7H,1H3,(H2,18,19,21,24)