3-butyl-1-[1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]-1-(pyridin-2-ylmethyl)urea

Systemtic Name: 3-butyl-1-[1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]-1-(pyridin-2-ylmethyl)urea Openeye Name: 3-butyl-1-[1-(6,7-dimethoxyquinazolin-4-yl)-4-piperidyl]-1-(2-pyridylmethyl)urea CAS Name: 3-butyl-1-[1-(6,7-dimethoxy-4-quinazolinyl)-4-piperidinyl]-1-(2-pyridinylmethyl)urea IUPAC Name: 3-butyl-1-[1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]-1-(pyridin-2-ylmethyl)urea Traditional Name: 3-butyl-1-[1-(6,7-dimethoxyquinazolin-4-yl)-4-piperidyl]-1-(2-pyridylmethyl)urea Formula: C26H34N6O3 MolecularWeight: 478.58656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CC1=CC=CC=N1)C2CCN(CC2)C3=NC=NC4=CC(=C(C=C43)OC)OC

Isomeric SMILES

CCCCNC(=O)N(CC1=CC=CC=N1)C2CCN(CC2)C3=NC=NC4=CC(=C(C=C43)OC)OC

InChI

InChI=1S/C26H34N6O3/c1-4-5-11-28-26(33)32(17-19-8-6-7-12-27-19)20-9-13-31(14-10-20)25-21-15-23(34-2)24(35-3)16-22(21)29-18-30-25/h6-8,12,15-16,18,20H,4-5,9-11,13-14,17H2,1-3H3,(H,28,33)