S-(4-methoxyphenyl) N-(2-methyl-5-nitro-phenyl)carbamothioate

Systemtic Name: S-(4-methoxyphenyl) N-(2-methyl-5-nitro-phenyl)carbamothioate Openeye Name: S-(4-methoxyphenyl) N-(2-methyl-5-nitro-phenyl)carbamothioate CAS Name: N-(2-methyl-5-nitrophenyl)carbamothioic acid S-(4-methoxyphenyl) ester IUPAC Name: S-(4-methoxyphenyl) N-(2-methyl-5-nitrophenyl)carbamothioate Traditional Name: N-(2-methyl-5-nitro-phenyl)thiocarbamic acid S-(4-methoxyphenyl) ester Formula: C15H14N2O4S MolecularWeight: 318.34766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)SC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)SC2=CC=C(C=C2)OC

InChI

InChI=1S/C15H14N2O4S/c1-10-3-4-11(17(19)20)9-14(10)16-15(18)22-13-7-5-12(21-2)6-8-13/h3-9H,1-2H3,(H,16,18)