3-(4-ethylphenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(4-ethylphenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(4-ethylphenyl)-1-(3-morpholinopropyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-(4-ethylphenyl)-1-[3-(4-morpholinyl)propyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(4-ethylphenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(4-ethylphenyl)-1-(3-morpholinopropyl)-1-(3-pyridylmethyl)thiourea Formula: C22H30N4OS MolecularWeight: 398.5648

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N(CCCN2CCOCC2)CC3=CN=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N(CCCN2CCOCC2)CC3=CN=CC=C3

InChI

InChI=1S/C22H30N4OS/c1-2-19-6-8-21(9-7-19)24-22(28)26(18-20-5-3-10-23-17-20)12-4-11-25-13-15-27-16-14-25/h3,5-10,17H,2,4,11-16,18H2,1H3,(H,24,28)