3-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-5-ethyl-5-methyl-cyclohex-2-en-1-one

Systemtic Name: 3-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-5-ethyl-5-methyl-cyclohex-2-en-1-one Openeye Name: 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-5-ethyl-5-methyl-cyclohex-2-en-1-one CAS Name: 3-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-5-ethyl-5-methyl-1-cyclohex-2-enone IUPAC Name: 3-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-5-ethyl-5-methylcyclohex-2-en-1-one Traditional Name: 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-5-ethyl-5-methyl-cyclohex-2-en-1-one Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(=CC(=O)C1)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC)C

Isomeric SMILES

CCC1(CC(=CC(=O)C1)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC)C

InChI

InChI=1S/C23H31N5O3/c1-5-23(2)13-15(10-16(29)14-23)27-6-8-28(9-7-27)22-25-18-12-20(31-4)19(30-3)11-17(18)21(24)26-22/h10-12H,5-9,13-14H2,1-4H3,(H2,24,25,26)