6-chloranyl-1,3-dimethyl-7-[2-(1-piperidin-1-ylcyclohexyl)ethynyl]pteridine-2,4-dione

Systemtic Name: 6-chloranyl-1,3-dimethyl-7-[2-(1-piperidin-1-ylcyclohexyl)ethynyl]pteridine-2,4-dione Openeye Name: 6-chloro-1,3-dimethyl-7-[2-[1-(1-piperidyl)cyclohexyl]ethynyl]pteridine-2,4-dione CAS Name: 6-chloro-1,3-dimethyl-7-[2-[1-(1-piperidinyl)cyclohexyl]ethynyl]pteridine-2,4-dione IUPAC Name: 6-chloro-1,3-dimethyl-7-[2-(1-piperidin-1-ylcyclohexyl)ethynyl]pteridine-2,4-dione Traditional Name: 6-chloro-1,3-dimethyl-7-[2-(1-piperidinocyclohexyl)ethynyl]pteridine-2,4-quinone Formula: C21H26ClN5O2 MolecularWeight: 415.91644

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=C(N=C2C(=O)N(C1=O)C)Cl)C#CC3(CCCCC3)N4CCCCC4

Isomeric SMILES

CN1C2=NC(=C(N=C2C(=O)N(C1=O)C)Cl)C#CC3(CCCCC3)N4CCCCC4

InChI

InChI=1S/C21H26ClN5O2/c1-25-18-16(19(28)26(2)20(25)29)24-17(22)15(23-18)9-12-21(10-5-3-6-11-21)27-13-7-4-8-14-27/h3-8,10-11,13-14H2,1-2H3