N-(2,5-dimethoxy-4-nitro-phenyl)-4-methyl-benzenecarbothioamide

Systemtic Name: N-(2,5-dimethoxy-4-nitro-phenyl)-4-methyl-benzenecarbothioamide Openeye Name: N-(2,5-dimethoxy-4-nitro-phenyl)-4-methyl-benzenecarbothioamide CAS Name: N-(2,5-dimethoxy-4-nitrophenyl)-4-methylbenzenecarbothioamide IUPAC Name: N-(2,5-dimethoxy-4-nitrophenyl)-4-methylbenzenecarbothioamide Traditional Name: N-(2,5-dimethoxy-4-nitro-phenyl)-4-methyl-thiobenzamide Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=S)NC2=CC(=C(C=C2OC)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=S)NC2=CC(=C(C=C2OC)[N+](=O)[O-])OC

InChI

InChI=1S/C16H16N2O4S/c1-10-4-6-11(7-5-10)16(23)17-12-8-15(22-3)13(18(19)20)9-14(12)21-2/h4-9H,1-3H3,(H,17,23)