3-(2,6-diethylphenyl)-1-(2-morpholin-4-ylethyl)-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 3-(2,6-diethylphenyl)-1-(2-morpholin-4-ylethyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-(2,6-diethylphenyl)-1-(2-morpholinoethyl)-1-(4-pyridylmethyl)thiourea CAS Name: 3-(2,6-diethylphenyl)-1-[2-(4-morpholinyl)ethyl]-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-(2,6-diethylphenyl)-1-(2-morpholin-4-ylethyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 3-(2,6-diethylphenyl)-1-(2-morpholinoethyl)-1-(4-pyridylmethyl)thiourea Formula: C23H32N4OS MolecularWeight: 412.59138

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N(CCN2CCOCC2)CC3=CC=NC=C3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N(CCN2CCOCC2)CC3=CC=NC=C3

InChI

InChI=1S/C23H32N4OS/c1-3-20-6-5-7-21(4-2)22(20)25-23(29)27(18-19-8-10-24-11-9-19)13-12-26-14-16-28-17-15-26/h5-11H,3-4,12-18H2,1-2H3,(H,25,29)