[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-(3,5-dibutyl-4-ethoxy-phenyl)methanone

Systemtic Name: [4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-(3,5-dibutyl-4-ethoxy-phenyl)methanone Openeye Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-(3,5-dibutyl-4-ethoxy-phenyl)methanone CAS Name: [4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-(3,5-dibutyl-4-ethoxyphenyl)methanone IUPAC Name: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(3,5-dibutyl-4-ethoxyphenyl)methanone Traditional Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-(3,5-dibutyl-4-ethoxy-phenyl)methanone Formula: C31H43N5O4 MolecularWeight: 549.70422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC(=C1OCC)CCCC)C(=O)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

Isomeric SMILES

CCCCC1=CC(=CC(=C1OCC)CCCC)C(=O)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

InChI

InChI=1S/C31H43N5O4/c1-6-9-11-21-17-23(18-22(12-10-7-2)28(21)40-8-3)30(37)35-13-15-36(16-14-35)31-33-25-20-27(39-5)26(38-4)19-24(25)29(32)34-31/h17-20H,6-16H2,1-5H3,(H2,32,33,34)