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

Systemtic Name: 6-azanyl-2-[4-(4-bromophenyl)-4-oxidanylidene-butyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[4-(4-bromophenyl)-4-oxo-butyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[4-(4-bromophenyl)-4-oxobutyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[4-(4-bromophenyl)-4-oxobutyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[4-(4-bromophenyl)-4-keto-butyl]thio]-1H-pyrimidin-4-one Formula: C14H14BrN3O2S MolecularWeight: 368.24886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCSC2=NC(=O)C=C(N2)N)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCSC2=NC(=O)C=C(N2)N)Br

InChI

InChI=1S/C14H14BrN3O2S/c15-10-5-3-9(4-6-10)11(19)2-1-7-21-14-17-12(16)8-13(20)18-14/h3-6,8H,1-2,7H2,(H3,16,17,18,20)