4-methyl-N-[(4-methyl-2-oxidanyl-phenyl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: 4-methyl-N-[(4-methyl-2-oxidanyl-phenyl)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[(2-hydroxy-4-methyl-phenyl)carbamothioyl]-4-methyl-3-nitro-benzamide CAS Name: N-[(2-hydroxy-4-methylanilino)-sulfanylidenemethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[(2-hydroxy-4-methyl-phenyl)thiocarbamoyl]-4-methyl-3-nitro-benzamide Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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