S-(4-methyl-2-nitro-phenyl) N-[2-(4-methoxyphenoxy)ethyl]carbamothioate

Systemtic Name: S-(4-methyl-2-nitro-phenyl) N-[2-(4-methoxyphenoxy)ethyl]carbamothioate Openeye Name: S-(4-methyl-2-nitro-phenyl) N-[2-(4-methoxyphenoxy)ethyl]carbamothioate CAS Name: N-[2-(4-methoxyphenoxy)ethyl]carbamothioic acid S-(4-methyl-2-nitrophenyl) ester IUPAC Name: S-(4-methyl-2-nitrophenyl) N-[2-(4-methoxyphenoxy)ethyl]carbamothioate Traditional Name: N-[2-(4-methoxyphenoxy)ethyl]thiocarbamic acid S-(4-methyl-2-nitro-phenyl) ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC(=O)NCCOC2=CC=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)SC(=O)NCCOC2=CC=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O5S/c1-12-3-8-16(15(11-12)19(21)22)25-17(20)18-9-10-24-14-6-4-13(23-2)5-7-14/h3-8,11H,9-10H2,1-2H3,(H,18,20)