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

Systemtic Name: 4-methoxy-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 4-methoxy-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]benzamide CAS Name: 4-methoxy-N-[(2-methyl-5-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-methoxy-N-[(2-methyl-5-nitrophenyl)carbamothioyl]benzamide Traditional Name: 4-methoxy-N-[(2-methyl-5-nitro-phenyl)thiocarbamoyl]benzamide Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O4S/c1-10-3-6-12(19(21)22)9-14(10)17-16(24)18-15(20)11-4-7-13(23-2)8-5-11/h3-9H,1-2H3,(H2,17,18,20,24)