6-(4-dimethylaminophenyl)-4-oxidanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-dimethylaminophenyl)-4-oxidanylidene-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-dimethylaminophenyl)-4-oxo-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-dimethylaminophenyl)-4-oxo-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-dimethylaminophenyl)-4-oxo-2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(4-dimethylaminophenyl)-4-keto-2-[(2-keto-2-piperidino-ethyl)thio]-1H-pyrimidine-5-carbonitrile Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)SCC(=O)N3CCCCC3)C#N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)SCC(=O)N3CCCCC3)C#N

InChI

InChI=1S/C20H23N5O2S/c1-24(2)15-8-6-14(7-9-15)18-16(12-21)19(27)23-20(22-18)28-13-17(26)25-10-4-3-5-11-25/h6-9H,3-5,10-11,13H2,1-2H3,(H,22,23,27)