2-[4-(4-bromophenyl)-4-oxidanylidene-butyl]sulfanyl-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(4-bromophenyl)-4-oxidanylidene-butyl]sulfanyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[4-(4-bromophenyl)-4-oxo-butyl]sulfanyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[[4-(4-bromophenyl)-4-oxobutyl]thio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[4-(4-bromophenyl)-4-oxobutyl]sulfanyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[[4-(4-bromophenyl)-4-keto-butyl]thio]-6-methyl-1H-pyrimidin-4-one Formula: C15H15BrN2O2S MolecularWeight: 367.2608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15BrN2O2S/c1-10-9-14(20)18-15(17-10)21-8-2-3-13(19)11-4-6-12(16)7-5-11/h4-7,9H,2-3,8H2,1H3,(H,17,18,20)