1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-methyl-2-(3-methylphenoxy)butan-1-one

Systemtic Name: 1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-methyl-2-(3-methylphenoxy)butan-1-one Openeye Name: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-methyl-2-(3-methylphenoxy)butan-1-one CAS Name: 1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-3-methyl-2-(3-methylphenoxy)-1-butanone IUPAC Name: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-3-methyl-2-(3-methylphenoxy)butan-1-one Traditional Name: 1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-3-methyl-2-(3-methylphenoxy)butan-1-one Formula: C26H33N5O4 MolecularWeight: 479.57132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(C(C)C)C(=O)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)OC(C(C)C)C(=O)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

InChI

InChI=1S/C26H33N5O4/c1-16(2)23(35-18-8-6-7-17(3)13-18)25(32)30-9-11-31(12-10-30)26-28-20-15-22(34-5)21(33-4)14-19(20)24(27)29-26/h6-8,13-16,23H,9-12H2,1-5H3,(H2,27,28,29)