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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N(CC1=CC(=C(C=C1)OC)OC)CC2=CN=CC=C2

Isomeric SMILES

CNC(=S)N(CC1=CC(=C(C=C1)OC)OC)CC2=CN=CC=C2

InChI

InChI=1S/C17H21N3O2S/c1-18-17(23)20(12-14-5-4-8-19-10-14)11-13-6-7-15(21-2)16(9-13)22-3/h4-10H,11-12H2,1-3H3,(H,18,23)