S-(2-methylphenyl) N-(4-methyl-2-nitro-phenyl)carbamothioate

Systemtic Name: S-(2-methylphenyl) N-(4-methyl-2-nitro-phenyl)carbamothioate Openeye Name: S-(o-tolyl) N-(4-methyl-2-nitro-phenyl)carbamothioate CAS Name: N-(4-methyl-2-nitrophenyl)carbamothioic acid S-(2-methylphenyl) ester IUPAC Name: S-(2-methylphenyl) N-(4-methyl-2-nitrophenyl)carbamothioate Traditional Name: N-(4-methyl-2-nitro-phenyl)thiocarbamic acid S-(o-tolyl) ester Formula: C15H14N2O3S MolecularWeight: 302.34826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)SC2=CC=CC=C2C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)SC2=CC=CC=C2C)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O3S/c1-10-7-8-12(13(9-10)17(19)20)16-15(18)21-14-6-4-3-5-11(14)2/h3-9H,1-2H3,(H,16,18)