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

Systemtic Name: 3-(2-methoxy-4-methyl-phenyl)-1-[(3-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(2-methoxy-4-methyl-phenyl)-1-(m-tolylmethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-(2-methoxy-4-methylphenyl)-1-[(3-methylphenyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(2-methoxy-4-methylphenyl)-1-[(3-methylphenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(2-methoxy-4-methyl-phenyl)-1-(3-methylbenzyl)-1-(3-pyridylmethyl)thiourea Formula: C23H25N3OS MolecularWeight: 391.5291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3OS/c1-17-6-4-7-19(12-17)15-26(16-20-8-5-11-24-14-20)23(28)25-21-10-9-18(2)13-22(21)27-3/h4-14H,15-16H2,1-3H3,(H,25,28)