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

Systemtic Name: 5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(2-morpholin-4-ylethyl)pentanamide Openeye Name: 5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-(2-morpholinoethyl)pentanamide CAS Name: 5-[[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-[2-(4-morpholinyl)ethyl]pentanamide IUPAC Name: 5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(2-morpholin-4-ylethyl)pentanamide Traditional Name: 5-[[5-(4-bromobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(2-morpholinoethyl)valeramide Formula: C24H33BrN4O3S MolecularWeight: 537.51282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SCCCCC(=O)NCCN2CCOCC2)C)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SCCCCC(=O)NCCN2CCOCC2)C)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C24H33BrN4O3S/c1-18-21(17-19-6-8-20(25)9-7-19)23(31)28(2)24(27-18)33-16-4-3-5-22(30)26-10-11-29-12-14-32-15-13-29/h6-9H,3-5,10-17H2,1-2H3,(H,26,30)