9-cyclopentyl-5,7,7-trimethyl-2-(1-pyridin-3-ylethylamino)-8H-pyrimido[4,5-b][1,4]diazepin-6-one

Systemtic Name: 9-cyclopentyl-5,7,7-trimethyl-2-(1-pyridin-3-ylethylamino)-8H-pyrimido[4,5-b][1,4]diazepin-6-one Openeye Name: 9-cyclopentyl-5,7,7-trimethyl-2-[1-(3-pyridyl)ethylamino]-8H-pyrimido[4,5-b][1,4]diazepin-6-one CAS Name: 9-cyclopentyl-5,7,7-trimethyl-2-[1-(3-pyridinyl)ethylamino]-8H-pyrimido[4,5-b][1,4]diazepin-6-one IUPAC Name: 9-cyclopentyl-5,7,7-trimethyl-2-(1-pyridin-3-ylethylamino)-8H-pyrimido[4,5-b][1,4]diazepin-6-one Traditional Name: 9-cyclopentyl-5,7,7-trimethyl-2-[1-(3-pyridyl)ethylamino]-8H-pyrimido[4,5-b][1,4]diazepin-6-one Formula: C22H30N6O MolecularWeight: 394.5132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)NC2=NC=C3C(=N2)N(CC(C(=O)N3C)(C)C)C4CCCC4

Isomeric SMILES

CC(C1=CN=CC=C1)NC2=NC=C3C(=N2)N(CC(C(=O)N3C)(C)C)C4CCCC4

InChI

InChI=1S/C22H30N6O/c1-15(16-8-7-11-23-12-16)25-21-24-13-18-19(26-21)28(17-9-5-6-10-17)14-22(2,3)20(29)27(18)4/h7-8,11-13,15,17H,5-6,9-10,14H2,1-4H3,(H,24,25,26)