6-(4-bromophenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carbonitrile; piperidine

Systemtic Name: 6-(4-bromophenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carbonitrile; piperidine Openeye Name: 6-(4-bromophenyl)-4-oxo-2-thioxo-1H-pyrimidine-5-carbonitrile; piperidine CAS Name: 6-(4-bromophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile; piperidine IUPAC Name: 6-(4-bromophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile; piperidine Traditional Name: 6-(4-bromophenyl)-4-keto-2-thioxo-1H-pyrimidine-5-carbonitrile; piperidine Formula: C16H17BrN4OS MolecularWeight: 393.30138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNCC1.C1=CC(=CC=C1C2=C(C(=O)NC(=S)N2)C#N)Br

Isomeric SMILES

C1CCNCC1.C1=CC(=CC=C1C2=C(C(=O)NC(=S)N2)C#N)Br

InChI

InChI=1S/C11H6BrN3OS.C5H11N/c12-7-3-1-6(2-4-7)9-8(5-13)10(16)15-11(17)14-9;1-2-4-6-5-3-1/h1-4H,(H2,14,15,16,17);6H,1-5H2