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

Systemtic Name: 1-(3-morpholin-4-ylpropyl)-3-(4-phenoxyphenyl)-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 1-(3-morpholinopropyl)-3-(4-phenoxyphenyl)-1-(2-pyridylmethyl)thiourea CAS Name: 1-[3-(4-morpholinyl)propyl]-3-(4-phenoxyphenyl)-1-(2-pyridinylmethyl)thiourea IUPAC Name: 1-(3-morpholin-4-ylpropyl)-3-(4-phenoxyphenyl)-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 1-(3-morpholinopropyl)-3-(4-phenoxyphenyl)-1-(2-pyridylmethyl)thiourea Formula: C26H30N4O2S MolecularWeight: 462.607

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(CC2=CC=CC=N2)C(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCCN(CC2=CC=CC=N2)C(=S)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H30N4O2S/c33-26(28-22-10-12-25(13-11-22)32-24-8-2-1-3-9-24)30(21-23-7-4-5-14-27-23)16-6-15-29-17-19-31-20-18-29/h1-5,7-14H,6,15-21H2,(H,28,33)