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

Systemtic Name: 4-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(3-methylbutan-2-yl)butanamide Openeye Name: 4-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-(1,2-dimethylpropyl)butanamide CAS Name: 4-[[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-(3-methylbutan-2-yl)butanamide IUPAC Name: 4-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(3-methylbutan-2-yl)butanamide Traditional Name: 4-[[5-(4-bromobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(1,2-dimethylpropyl)butyramide Formula: C22H30BrN3O2S MolecularWeight: 480.4615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SCCCC(=O)NC(C)C(C)C)C)CC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SCCCC(=O)NC(C)C(C)C)C)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C22H30BrN3O2S/c1-14(2)15(3)24-20(27)7-6-12-29-22-25-16(4)19(21(28)26(22)5)13-17-8-10-18(23)11-9-17/h8-11,14-15H,6-7,12-13H2,1-5H3,(H,24,27)