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

Systemtic Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(3,4-dimethylphenyl)pentanamide Openeye Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-(3,4-dimethylphenyl)pentanamide CAS Name: 2-[[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-(3,4-dimethylphenyl)pentanamide IUPAC Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(3,4-dimethylphenyl)pentanamide Traditional Name: 2-[[5-(4-bromobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(3,4-dimethylphenyl)valeramide Formula: C26H30BrN3O2S MolecularWeight: 528.5043

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=CC(=C(C=C1)C)C)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)Br)C

Isomeric SMILES

CCCC(C(=O)NC1=CC(=C(C=C1)C)C)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C26H30BrN3O2S/c1-6-7-23(24(31)29-21-13-8-16(2)17(3)14-21)33-26-28-18(4)22(25(32)30(26)5)15-19-9-11-20(27)12-10-19/h8-14,23H,6-7,15H2,1-5H3,(H,29,31)