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

Systemtic Name: 3-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-4,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-4,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-4,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-4,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-4,5-dimethyl-cyclohex-2-en-1-one Formula: C22H29N5O3 MolecularWeight: 411.49736

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C=C(C1C)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

Isomeric SMILES

CC1CC(=O)C=C(C1C)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

InChI

InChI=1S/C22H29N5O3/c1-13-9-15(28)10-18(14(13)2)26-5-7-27(8-6-26)22-24-17-12-20(30-4)19(29-3)11-16(17)21(23)25-22/h10-14H,5-9H2,1-4H3,(H2,23,24,25)