1-[(2,6-dimethylphenyl)methyl]-1-ethyl-3-pyridin-4-yl-thiourea

Systemtic Name: 1-[(2,6-dimethylphenyl)methyl]-1-ethyl-3-pyridin-4-yl-thiourea Openeye Name: 1-[(2,6-dimethylphenyl)methyl]-1-ethyl-3-(4-pyridyl)thiourea CAS Name: 1-[(2,6-dimethylphenyl)methyl]-1-ethyl-3-pyridin-4-ylthiourea IUPAC Name: 1-[(2,6-dimethylphenyl)methyl]-1-ethyl-3-pyridin-4-ylthiourea Traditional Name: 1-(2,6-dimethylbenzyl)-1-ethyl-3-(4-pyridyl)thiourea Formula: C17H21N3S MolecularWeight: 299.43374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC=C1C)C)C(=S)NC2=CC=NC=C2

Isomeric SMILES

CCN(CC1=C(C=CC=C1C)C)C(=S)NC2=CC=NC=C2

InChI

InChI=1S/C17H21N3S/c1-4-20(12-16-13(2)6-5-7-14(16)3)17(21)19-15-8-10-18-11-9-15/h5-11H,4,12H2,1-3H3,(H,18,19,21)