2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-6-methyl-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-6-methyl-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-6-methyl-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-4-keto-6-methyl-1H-pyrimidine-5-carbonitrile Formula: C14H10BrN3O2S MolecularWeight: 364.2171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC(=O)C2=CC=C(C=C2)Br)C#N

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(=O)C2=CC=C(C=C2)Br)C#N

InChI

InChI=1S/C14H10BrN3O2S/c1-8-11(6-16)13(20)18-14(17-8)21-7-12(19)9-2-4-10(15)5-3-9/h2-5H,7H2,1H3,(H,17,18,20)