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

Systemtic Name: 5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(2-pyrrolidin-1-ylethyl)pentanamide Openeye Name: 5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-(2-pyrrolidin-1-ylethyl)pentanamide CAS Name: 5-[[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-[2-(1-pyrrolidinyl)ethyl]pentanamide IUPAC Name: 5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(2-pyrrolidin-1-ylethyl)pentanamide Traditional Name: 5-[[5-(4-bromobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(2-pyrrolidinoethyl)valeramide Formula: C24H33BrN4O2S MolecularWeight: 521.51342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SCCCCC(=O)NCCN2CCCC2)C)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SCCCCC(=O)NCCN2CCCC2)C)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C24H33BrN4O2S/c1-18-21(17-19-8-10-20(25)11-9-19)23(31)28(2)24(27-18)32-16-6-3-7-22(30)26-12-15-29-13-4-5-14-29/h8-11H,3-7,12-17H2,1-2H3,(H,26,30)