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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-yl-thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-pyridyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylthiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyridin-4-ylthiourea Traditional Name: 1-homoveratryl-3-(4-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=NC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NC2=CC=NC=C2)OC

InChI

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