4-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]-N-(2-dimethylaminoethyl)cyclohexane-1-carboxamide

Systemtic Name: 4-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]-N-(2-dimethylaminoethyl)cyclohexane-1-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)cyclohexanecarboxamide CAS Name: N-(2-dimethylaminoethyl)-4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)-1-cyclohexanecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)cyclohexane-1-carboxamide Traditional Name: 4-(2,6-diketo-1,3-dipropyl-7H-purin-8-yl)-N-(2-dimethylaminoethyl)cyclohexanecarboxamide Formula: C22H36N6O3 MolecularWeight: 432.55964

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3CCC(CC3)C(=O)NCCN(C)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3CCC(CC3)C(=O)NCCN(C)C

InChI

InChI=1S/C22H36N6O3/c1-5-12-27-19-17(21(30)28(13-6-2)22(27)31)24-18(25-19)15-7-9-16(10-8-15)20(29)23-11-14-26(3)4/h15-16H,5-14H2,1-4H3,(H,23,29)(H,24,25)