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O-(2-pyridin-2-ylethyl) N-(4-chloranyl-3-nitro-phenyl)carbamothioate

O-(2-pyridin-2-ylethyl) N-(4-chloranyl-3-nitro-phenyl)carbamothioate

Systemtic Name:O-(2-pyridin-2-ylethyl) N-(4-chloranyl-3-nitro-phenyl)carbamothioate
Openeye Name:O-[2-(2-pyridyl)ethyl] N-(4-chloro-3-nitro-phenyl)carbamothioate
CAS Name:N-(4-chloro-3-nitrophenyl)carbamothioic acid O-[2-(2-pyridinyl)ethyl] ester
IUPAC Name:O-(2-pyridin-2-ylethyl) N-(4-chloro-3-nitrophenyl)carbamothioate
Traditional Name:N-(4-chloro-3-nitro-phenyl)thiocarbamic acid O-[2-(2-pyridyl)ethyl] ester
Formula: C14H12ClN3O3S
MolecularWeight: 337.78138
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C14H12ClN3O3S/c15-12-5-4-11(9-13(12)18(19)20)17-14(22)21-8-6-10-3-1-2-7-16-10/h1-5,7,9H,6,8H2,(H,17,22)


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