1-(5-chloranylpyridin-2-yl)-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-(5-chloranylpyridin-2-yl)-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-(5-chloro-2-pyridyl)-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-(5-chloro-2-pyridinyl)-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-(5-chloropyridin-2-yl)-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-(5-chloro-2-pyridyl)-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C13H11ClN4O3S MolecularWeight: 338.76944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=NC=C(C=C2)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C13H11ClN4O3S/c1-21-11-6-9(18(19)20)3-4-10(11)16-13(22)17-12-5-2-8(14)7-15-12/h2-7H,1H3,(H2,15,16,17,22)