3-(3,5-dimethoxyphenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 3-(3,5-dimethoxyphenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-(3,5-dimethoxyphenyl)-1-(3-morpholinopropyl)-1-(4-pyridylmethyl)thiourea CAS Name: 3-(3,5-dimethoxyphenyl)-1-[3-(4-morpholinyl)propyl]-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-(3,5-dimethoxyphenyl)-1-(3-morpholin-4-ylpropyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 3-(3,5-dimethoxyphenyl)-1-(3-morpholinopropyl)-1-(4-pyridylmethyl)thiourea Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=S)N(CCCN2CCOCC2)CC3=CC=NC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=S)N(CCCN2CCOCC2)CC3=CC=NC=C3)OC

InChI

InChI=1S/C22H30N4O3S/c1-27-20-14-19(15-21(16-20)28-2)24-22(30)26(17-18-4-6-23-7-5-18)9-3-8-25-10-12-29-13-11-25/h4-7,14-16H,3,8-13,17H2,1-2H3,(H,24,30)