N-[(5-methoxy-2-oxidanyl-phenyl)carbamothioyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[(5-methoxy-2-oxidanyl-phenyl)carbamothioyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[(2-hydroxy-5-methoxy-phenyl)carbamothioyl]-4-methyl-3-nitro-benzamide CAS Name: N-[(2-hydroxy-5-methoxyanilino)-sulfanylidenemethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[(2-hydroxy-5-methoxyphenyl)carbamothioyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[(2-hydroxy-5-methoxy-phenyl)thiocarbamoyl]-4-methyl-3-nitro-benzamide Formula: C16H15N3O5S MolecularWeight: 361.3724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)OC)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)OC)O)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O5S/c1-9-3-4-10(7-13(9)19(22)23)15(21)18-16(25)17-12-8-11(24-2)5-6-14(12)20/h3-8,20H,1-2H3,(H2,17,18,21,25)