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

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-(furan-2-yl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-6-(2-furyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-6-(2-furanyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-6-(furan-2-yl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-6-(2-furyl)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C17H10BrN3O3S MolecularWeight: 416.2486

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=C(C(=O)N=C(N2)SCC(=O)C3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1=COC(=C1)C2=C(C(=O)N=C(N2)SCC(=O)C3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C17H10BrN3O3S/c18-11-5-3-10(4-6-11)13(22)9-25-17-20-15(14-2-1-7-24-14)12(8-19)16(23)21-17/h1-7H,9H2,(H,20,21,23)