[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]-(4-oxidanyl-3,5-dipropyl-phenyl)methanone

Systemtic Name: [4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]-(4-oxidanyl-3,5-dipropyl-phenyl)methanone Openeye Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]-(4-hydroxy-3,5-dipropyl-phenyl)methanone CAS Name: [4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1,4-diazepan-1-yl]-(4-hydroxy-3,5-dipropylphenyl)methanone IUPAC Name: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-1,4-diazepan-1-yl]-(4-hydroxy-3,5-dipropylphenyl)methanone Traditional Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]-(4-hydroxy-3,5-dipropyl-phenyl)methanone Formula: C28H37N5O4 MolecularWeight: 507.62448

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1O)CCC)C(=O)N2CCCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

Isomeric SMILES

CCCC1=CC(=CC(=C1O)CCC)C(=O)N2CCCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

InChI

InChI=1S/C28H37N5O4/c1-5-8-18-14-20(15-19(9-6-2)25(18)34)27(35)32-10-7-11-33(13-12-32)28-30-22-17-24(37-4)23(36-3)16-21(22)26(29)31-28/h14-17,34H,5-13H2,1-4H3,(H2,29,30,31)