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

Systemtic Name: 3-(4-ethoxyphenyl)-1-(2-morpholin-4-ylethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(4-ethoxyphenyl)-1-(2-morpholinoethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-(4-ethoxyphenyl)-1-[2-(4-morpholinyl)ethyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(4-ethoxyphenyl)-1-(2-morpholin-4-ylethyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(2-morpholinoethyl)-3-p-phenetyl-1-(3-pyridylmethyl)thiourea Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CCN2CCOCC2)CC3=CN=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CCN2CCOCC2)CC3=CN=CC=C3

InChI

InChI=1S/C21H28N4O2S/c1-2-27-20-7-5-19(6-8-20)23-21(28)25(17-18-4-3-9-22-16-18)11-10-24-12-14-26-15-13-24/h3-9,16H,2,10-15,17H2,1H3,(H,23,28)