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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(pyridin-2-ylmethyl)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-pyridylmethyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-pyridinylmethyl)thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(pyridin-2-ylmethyl)thiourea Traditional Name: 1-homoveratryl-3-(2-pyridylmethyl)thiourea Formula: C17H21N3O2S MolecularWeight: 331.43254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NCC2=CC=CC=N2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NCC2=CC=CC=N2)OC

InChI

InChI=1S/C17H21N3O2S/c1-21-15-7-6-13(11-16(15)22-2)8-10-19-17(23)20-12-14-5-3-4-9-18-14/h3-7,9,11H,8,10,12H2,1-2H3,(H2,19,20,23)