1-(3-cyanopyridin-2-yl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea

Systemtic Name: 1-(3-cyanopyridin-2-yl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1-(3-cyano-2-pyridyl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea CAS Name: 1-(3-cyano-2-pyridinyl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-(3-cyanopyridin-2-yl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-(3-cyano-2-pyridyl)-3-[2-(2,5-dimethoxyphenyl)ethyl]thiourea Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CCNC(=S)NC2=C(C=CC=N2)C#N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CCNC(=S)NC2=C(C=CC=N2)C#N

InChI

InChI=1S/C17H18N4O2S/c1-22-14-5-6-15(23-2)12(10-14)7-9-20-17(24)21-16-13(11-18)4-3-8-19-16/h3-6,8,10H,7,9H2,1-2H3,(H2,19,20,21,24)