[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]-(3-methoxy-4-phenylmethoxy-phenyl)methanone

Systemtic Name: [4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]-(3-methoxy-4-phenylmethoxy-phenyl)methanone Openeye Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]-(4-benzyloxy-3-methoxy-phenyl)methanone CAS Name: [4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1,4-diazepan-1-yl]-(3-methoxy-4-phenylmethoxyphenyl)methanone IUPAC Name: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-1,4-diazepan-1-yl]-(3-methoxy-4-phenylmethoxyphenyl)methanone Traditional Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-1,4-diazepan-1-yl]-(4-benzoxy-3-methoxy-phenyl)methanone Formula: C30H33N5O5 MolecularWeight: 543.61352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)N2CCCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)N2CCCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC)OCC5=CC=CC=C5

InChI

InChI=1S/C30H33N5O5/c1-37-25-16-21(10-11-24(25)40-19-20-8-5-4-6-9-20)29(36)34-12-7-13-35(15-14-34)30-32-23-18-27(39-3)26(38-2)17-22(23)28(31)33-30/h4-6,8-11,16-18H,7,12-15,19H2,1-3H3,(H2,31,32,33)