3-(4-ethoxyphenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)thiourea

Systemtic Name: 3-(4-ethoxyphenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 3-(4-ethoxyphenyl)-1-(3-morpholinopropyl)-1-(2-pyridylmethyl)thiourea CAS Name: 3-(4-ethoxyphenyl)-1-[3-(4-morpholinyl)propyl]-1-(2-pyridinylmethyl)thiourea IUPAC Name: 3-(4-ethoxyphenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 1-(3-morpholinopropyl)-3-p-phenetyl-1-(2-pyridylmethyl)thiourea Formula: C22H30N4O2S MolecularWeight: 414.5642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CCCN2CCOCC2)CC3=CC=CC=N3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CCCN2CCOCC2)CC3=CC=CC=N3

InChI

InChI=1S/C22H30N4O2S/c1-2-28-21-9-7-19(8-10-21)24-22(29)26(18-20-6-3-4-11-23-20)13-5-12-25-14-16-27-17-15-25/h3-4,6-11H,2,5,12-18H2,1H3,(H,24,29)