1-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-2-yl-thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-2-yl-thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-pyridyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-pyridinyl)thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-2-ylthiourea Traditional Name: 1-homoveratryl-3-(2-pyridyl)thiourea Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O2S/c1-20-13-7-6-12(11-14(13)21-2)8-10-18-16(22)19-15-5-3-4-9-17-15/h3-7,9,11H,8,10H2,1-2H3,(H2,17,18,19,22)