3-(4-chloranyl-3-methyl-phenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)thiourea

Systemtic Name: 3-(4-chloranyl-3-methyl-phenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 3-(4-chloro-3-methyl-phenyl)-1-(p-tolylmethyl)-1-(2-pyridylmethyl)thiourea CAS Name: 3-(4-chloro-3-methylphenyl)-1-[(4-methylphenyl)methyl]-1-(2-pyridinylmethyl)thiourea IUPAC Name: 3-(4-chloro-3-methylphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 3-(4-chloro-3-methyl-phenyl)-1-(4-methylbenzyl)-1-(2-pyridylmethyl)thiourea Formula: C22H22ClN3S MolecularWeight: 395.94818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC2=CC=CC=N2)C(=S)NC3=CC(=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=CC=CC=N2)C(=S)NC3=CC(=C(C=C3)Cl)C

InChI

InChI=1S/C22H22ClN3S/c1-16-6-8-18(9-7-16)14-26(15-20-5-3-4-12-24-20)22(27)25-19-10-11-21(23)17(2)13-19/h3-13H,14-15H2,1-2H3,(H,25,27)