N-[(2-aminocarbonylphenyl)carbamothioyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[(2-aminocarbonylphenyl)carbamothioyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[(2-carbamoylphenyl)carbamothioyl]-2-methyl-3-nitro-benzamide CAS Name: N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[(2-carbamoylphenyl)carbamothioyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[(2-carbamoylphenyl)thiocarbamoyl]-2-methyl-3-nitro-benzamide Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC(=S)NC2=CC=CC=C2C(=O)N

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC(=S)NC2=CC=CC=C2C(=O)N

InChI

InChI=1S/C16H14N4O4S/c1-9-10(6-4-8-13(9)20(23)24)15(22)19-16(25)18-12-7-3-2-5-11(12)14(17)21/h2-8H,1H3,(H2,17,21)(H2,18,19,22,25)