N-[5-[1-cyclopropyl-2,6-bis(oxidanylidene)-3-propyl-7H-purin-8-yl]pyridin-2-yl]-N-(cyclopropylmethyl)benzamide

Systemtic Name: N-[5-[1-cyclopropyl-2,6-bis(oxidanylidene)-3-propyl-7H-purin-8-yl]pyridin-2-yl]-N-(cyclopropylmethyl)benzamide Openeye Name: N-[5-(1-cyclopropyl-2,6-dioxo-3-propyl-7H-purin-8-yl)-2-pyridyl]-N-(cyclopropylmethyl)benzamide CAS Name: N-[5-(1-cyclopropyl-2,6-dioxo-3-propyl-7H-purin-8-yl)-2-pyridinyl]-N-(cyclopropylmethyl)benzamide IUPAC Name: N-[5-(1-cyclopropyl-2,6-dioxo-3-propyl-7H-purin-8-yl)pyridin-2-yl]-N-(cyclopropylmethyl)benzamide Traditional Name: N-[5-(1-cyclopropyl-2,6-diketo-3-propyl-7H-purin-8-yl)-2-pyridyl]-N-(cyclopropylmethyl)benzamide Formula: C27H28N6O3 MolecularWeight: 484.54962

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)C3CC3)NC(=N2)C4=CN=C(C=C4)N(CC5CC5)C(=O)C6=CC=CC=C6

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)C3CC3)NC(=N2)C4=CN=C(C=C4)N(CC5CC5)C(=O)C6=CC=CC=C6

InChI

InChI=1S/C27H28N6O3/c1-2-14-31-24-22(26(35)33(27(31)36)20-11-12-20)29-23(30-24)19-10-13-21(28-15-19)32(16-17-8-9-17)25(34)18-6-4-3-5-7-18/h3-7,10,13,15,17,20H,2,8-9,11-12,14,16H2,1H3,(H,29,30)