3-(2-chloranyl-5-methyl-phenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 3-(2-chloranyl-5-methyl-phenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-(2-chloro-5-methyl-phenyl)-1-(p-tolylmethyl)-1-(4-pyridylmethyl)thiourea CAS Name: 3-(2-chloro-5-methylphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-(2-chloro-5-methylphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 3-(2-chloro-5-methyl-phenyl)-1-(4-methylbenzyl)-1-(4-pyridylmethyl)thiourea Formula: C22H22ClN3S MolecularWeight: 395.94818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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