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

Systemtic Name: 4-chloranyl-N-[(3-methoxyphenyl)carbamothioyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(3-methoxyphenyl)carbamothioyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(3-methoxyanilino)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(3-methoxyphenyl)carbamothioyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(3-methoxyphenyl)thiocarbamoyl]-3-nitro-benzamide Formula: C15H12ClN3O4S MolecularWeight: 365.79148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H12ClN3O4S/c1-23-11-4-2-3-10(8-11)17-15(24)18-14(20)9-5-6-12(16)13(7-9)19(21)22/h2-8H,1H3,(H2,17,18,20,24)