3-(2-chloranyl-5-nitro-phenyl)-1-methyl-1-(2-pyridin-2-ylethyl)thiourea

Systemtic Name: 3-(2-chloranyl-5-nitro-phenyl)-1-methyl-1-(2-pyridin-2-ylethyl)thiourea Openeye Name: 3-(2-chloro-5-nitro-phenyl)-1-methyl-1-[2-(2-pyridyl)ethyl]thiourea CAS Name: 3-(2-chloro-5-nitrophenyl)-1-methyl-1-[2-(2-pyridinyl)ethyl]thiourea IUPAC Name: 3-(2-chloro-5-nitrophenyl)-1-methyl-1-(2-pyridin-2-ylethyl)thiourea Traditional Name: 3-(2-chloro-5-nitro-phenyl)-1-methyl-1-[2-(2-pyridyl)ethyl]thiourea Formula: C15H15ClN4O2S MolecularWeight: 350.8232

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CN(CCC1=CC=CC=N1)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H15ClN4O2S/c1-19(9-7-11-4-2-3-8-17-11)15(23)18-14-10-12(20(21)22)5-6-13(14)16/h2-6,8,10H,7,9H2,1H3,(H,18,23)