N-[(2,4-dimethoxyphenyl)carbamothioyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[(2,4-dimethoxyphenyl)carbamothioyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[(2,4-dimethoxyphenyl)carbamothioyl]-2-methyl-3-nitro-benzamide CAS Name: N-[(2,4-dimethoxyanilino)-sulfanylidenemethyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[(2,4-dimethoxyphenyl)carbamothioyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[(2,4-dimethoxyphenyl)thiocarbamoyl]-2-methyl-3-nitro-benzamide Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O5S/c1-10-12(5-4-6-14(10)20(22)23)16(21)19-17(26)18-13-8-7-11(24-2)9-15(13)25-3/h4-9H,1-3H3,(H2,18,19,21,26)