1-ethyl-2,4-bis(oxidanylidene)-3-[2-oxidanylidene-2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)ethyl]pyrimidine-5-carbonitrile

Systemtic Name: 1-ethyl-2,4-bis(oxidanylidene)-3-[2-oxidanylidene-2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)ethyl]pyrimidine-5-carbonitrile Openeye Name: 1-ethyl-2,4-dioxo-3-[2-oxo-2-[5-(1-piperidylsulfonyl)indolin-1-yl]ethyl]pyrimidine-5-carbonitrile CAS Name: 1-ethyl-2,4-dioxo-3-[2-oxo-2-[5-(1-piperidinylsulfonyl)-2,3-dihydroindol-1-yl]ethyl]-5-pyrimidinecarbonitrile IUPAC Name: 1-ethyl-2,4-dioxo-3-[2-oxo-2-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)ethyl]pyrimidine-5-carbonitrile Traditional Name: 1-ethyl-2,4-diketo-3-[2-keto-2-(5-piperidinosulfonylindolin-1-yl)ethyl]pyrimidine-5-carbonitrile Formula: C22H25N5O5S MolecularWeight: 471.5294

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)N(C1=O)CC(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N4CCCCC4)C#N

Isomeric SMILES

CCN1C=C(C(=O)N(C1=O)CC(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N4CCCCC4)C#N

InChI

InChI=1S/C22H25N5O5S/c1-2-24-14-17(13-23)21(29)27(22(24)30)15-20(28)26-11-8-16-12-18(6-7-19(16)26)33(31,32)25-9-4-3-5-10-25/h6-7,12,14H,2-5,8-11,15H2,1H3