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

Systemtic Name: 1-[(4-ethoxyphenyl)methyl]-3-(2-methoxy-5-methyl-phenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[(4-ethoxyphenyl)methyl]-3-(2-methoxy-5-methyl-phenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[(4-ethoxyphenyl)methyl]-3-(2-methoxy-5-methylphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[(4-ethoxyphenyl)methyl]-3-(2-methoxy-5-methylphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(4-ethoxybenzyl)-3-(2-methoxy-5-methyl-phenyl)-1-(3-pyridylmethyl)thiourea Formula: C24H27N3O2S MolecularWeight: 421.55508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3=C(C=CC(=C3)C)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=S)NC3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C24H27N3O2S/c1-4-29-21-10-8-19(9-11-21)16-27(17-20-6-5-13-25-15-20)24(30)26-22-14-18(2)7-12-23(22)28-3/h5-15H,4,16-17H2,1-3H3,(H,26,30)