2-(4-chlorophenyl)-6-(4-ethylphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine

Systemtic Name: 2-(4-chlorophenyl)-6-(4-ethylphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine Openeye Name: 2-(4-chlorophenyl)-6-(4-ethylphenyl)sulfanyl-N-(3-morpholinopropyl)pyrimidin-4-amine CAS Name: 2-(4-chlorophenyl)-6-[(4-ethylphenyl)thio]-N-[3-(4-morpholinyl)propyl]-4-pyrimidinamine IUPAC Name: 2-(4-chlorophenyl)-6-(4-ethylphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine Traditional Name: [2-(4-chlorophenyl)-6-[(4-ethylphenyl)thio]pyrimidin-4-yl]-(3-morpholinopropyl)amine Formula: C25H29ClN4OS MolecularWeight: 469.04196

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)SC2=NC(=NC(=C2)NCCCN3CCOCC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)SC2=NC(=NC(=C2)NCCCN3CCOCC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H29ClN4OS/c1-2-19-4-10-22(11-5-19)32-24-18-23(27-12-3-13-30-14-16-31-17-15-30)28-25(29-24)20-6-8-21(26)9-7-20/h4-11,18H,2-3,12-17H2,1H3,(H,27,28,29)