2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(3-morpholin-4-ylpropyl)pentanamide

Systemtic Name: 2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(3-morpholin-4-ylpropyl)pentanamide Openeye Name: 2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-(3-morpholinopropyl)pentanamide CAS Name: 2-[[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-[3-(4-morpholinyl)propyl]pentanamide IUPAC Name: 2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(3-morpholin-4-ylpropyl)pentanamide Traditional Name: 2-[[5-(4-tert-butylbenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(3-morpholinopropyl)valeramide Formula: C29H44N4O3S MolecularWeight: 528.74966

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NCCCN1CCOCC1)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)C(C)(C)C)C

Isomeric SMILES

CCCC(C(=O)NCCCN1CCOCC1)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)C(C)(C)C)C

InChI

InChI=1S/C29H44N4O3S/c1-7-9-25(26(34)30-14-8-15-33-16-18-36-19-17-33)37-28-31-21(2)24(27(35)32(28)6)20-22-10-12-23(13-11-22)29(3,4)5/h10-13,25H,7-9,14-20H2,1-6H3,(H,30,34)