[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-[4-(1-phenylbutoxy)phenyl]methanone

Systemtic Name: [4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-[4-(1-phenylbutoxy)phenyl]methanone Openeye Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-[4-(1-phenylbutoxy)phenyl]methanone CAS Name: [4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-[4-(1-phenylbutoxy)phenyl]methanone IUPAC Name: [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-[4-(1-phenylbutoxy)phenyl]methanone Traditional Name: [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-[4-(1-phenylbutoxy)phenyl]methanone Formula: C31H35N5O4 MolecularWeight: 541.6407

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=CC(=C(C=C5C(=N4)N)OC)OC

Isomeric SMILES

CCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=CC(=C(C=C5C(=N4)N)OC)OC

InChI

InChI=1S/C31H35N5O4/c1-4-8-26(21-9-6-5-7-10-21)40-23-13-11-22(12-14-23)30(37)35-15-17-36(18-16-35)31-33-25-20-28(39-3)27(38-2)19-24(25)29(32)34-31/h5-7,9-14,19-20,26H,4,8,15-18H2,1-3H3,(H2,32,33,34)