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

Systemtic Name: (E)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-(1,3-benzodioxol-5-yl)prop-2-en-1-one Openeye Name: (E)-1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-(1,3-benzodioxol-5-yl)prop-2-en-1-one CAS Name: (E)-1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-3-(1,3-benzodioxol-5-yl)-2-propen-1-one IUPAC Name: (E)-1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-3-(1,3-benzodioxol-5-yl)prop-2-en-1-one Traditional Name: (E)-1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-3-(1,3-benzodioxol-5-yl)prop-2-en-1-one Formula: C24H25N5O5 MolecularWeight: 463.4858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C=CC4=CC5=C(C=C4)OCO5)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)/C=C/C4=CC5=C(C=C4)OCO5)N)OC

InChI

InChI=1S/C24H25N5O5/c1-31-19-12-16-17(13-20(19)32-2)26-24(27-23(16)25)29-9-7-28(8-10-29)22(30)6-4-15-3-5-18-21(11-15)34-14-33-18/h3-6,11-13H,7-10,14H2,1-2H3,(H2,25,26,27)/b6-4+