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

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(5-chloro-2-methoxy-phenyl)-1-(p-tolylmethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-(5-chloro-2-methoxyphenyl)-1-[(4-methylphenyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(5-chloro-2-methoxyphenyl)-1-[(4-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(5-chloro-2-methoxy-phenyl)-1-(4-methylbenzyl)-1-(3-pyridylmethyl)thiourea Formula: C22H22ClN3OS MolecularWeight: 411.94758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClN3OS/c1-16-5-7-17(8-6-16)14-26(15-18-4-3-11-24-13-18)22(28)25-20-12-19(23)9-10-21(20)27-2/h3-13H,14-15H2,1-2H3,(H,25,28)