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

Systemtic Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(3-morpholin-4-ylpropyl)pentanamide Openeye Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-(3-morpholinopropyl)pentanamide CAS Name: 2-[[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-[3-(4-morpholinyl)propyl]pentanamide IUPAC Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(3-morpholin-4-ylpropyl)pentanamide Traditional Name: 2-[[5-(4-bromobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(3-morpholinopropyl)valeramide Formula: C25H35BrN4O3S MolecularWeight: 551.5394

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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)Br)C

Isomeric SMILES

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

InChI

InChI=1S/C25H35BrN4O3S/c1-4-6-22(23(31)27-11-5-12-30-13-15-33-16-14-30)34-25-28-18(2)21(24(32)29(25)3)17-19-7-9-20(26)10-8-19/h7-10,22H,4-6,11-17H2,1-3H3,(H,27,31)