N-[(3-chloranyl-4-methoxy-phenyl)carbamothioyl]-2-nitro-benzamide

Systemtic Name: N-[(3-chloranyl-4-methoxy-phenyl)carbamothioyl]-2-nitro-benzamide Openeye Name: N-[(3-chloro-4-methoxy-phenyl)carbamothioyl]-2-nitro-benzamide CAS Name: N-[(3-chloro-4-methoxyanilino)-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[(3-chloro-4-methoxyphenyl)carbamothioyl]-2-nitrobenzamide Traditional Name: N-[(3-chloro-4-methoxy-phenyl)thiocarbamoyl]-2-nitro-benzamide Formula: C15H12ClN3O4S MolecularWeight: 365.79148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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