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

Systemtic Name: 3-(4-chloranyl-3-methyl-phenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(4-chloro-3-methyl-phenyl)-1-(p-tolylmethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-(4-chloro-3-methylphenyl)-1-[(4-methylphenyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(4-chloro-3-methylphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(4-chloro-3-methyl-phenyl)-1-(4-methylbenzyl)-1-(3-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=CN=CC=C2)C(=S)NC3=CC(=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3=CC(=C(C=C3)Cl)C

InChI

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