1-[4-(2,3-dimethoxyphenoxy)pyrimidin-5-yl]-3-(2,2-diphenylethyl)thiourea

Systemtic Name: 1-[4-(2,3-dimethoxyphenoxy)pyrimidin-5-yl]-3-(2,2-diphenylethyl)thiourea Openeye Name: 1-[4-(2,3-dimethoxyphenoxy)pyrimidin-5-yl]-3-(2,2-diphenylethyl)thiourea CAS Name: 1-[4-(2,3-dimethoxyphenoxy)-5-pyrimidinyl]-3-(2,2-diphenylethyl)thiourea IUPAC Name: 1-[4-(2,3-dimethoxyphenoxy)pyrimidin-5-yl]-3-(2,2-diphenylethyl)thiourea Traditional Name: 1-[4-(2,3-dimethoxyphenoxy)pyrimidin-5-yl]-3-(2,2-diphenylethyl)thiourea Formula: C27H26N4O3S MolecularWeight: 486.58534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)OC2=NC=NC=C2NC(=S)NCC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1OC)OC2=NC=NC=C2NC(=S)NCC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O3S/c1-32-23-14-9-15-24(25(23)33-2)34-26-22(17-28-18-30-26)31-27(35)29-16-21(19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-15,17-18,21H,16H2,1-2H3,(H2,29,31,35)