N-(1,3-benzodioxol-4-yl)-6-methoxy-7-[2-(4-methylpiperazin-1-yl)ethoxy]quinazolin-4-amine

Systemtic Name: N-(1,3-benzodioxol-4-yl)-6-methoxy-7-[2-(4-methylpiperazin-1-yl)ethoxy]quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-4-yl)-6-methoxy-7-[2-(4-methylpiperazin-1-yl)ethoxy]quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-4-yl)-6-methoxy-7-[2-(4-methyl-1-piperazinyl)ethoxy]-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-4-yl)-6-methoxy-7-[2-(4-methylpiperazin-1-yl)ethoxy]quinazolin-4-amine Traditional Name: 1,3-benzodioxol-4-yl-[6-methoxy-7-[2-(4-methylpiperazino)ethoxy]quinazolin-4-yl]amine Formula: C23H27N5O4 MolecularWeight: 437.49158

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCOC2=C(C=C3C(=C2)N=CN=C3NC4=C5C(=CC=C4)OCO5)OC

Isomeric SMILES

CN1CCN(CC1)CCOC2=C(C=C3C(=C2)N=CN=C3NC4=C5C(=CC=C4)OCO5)OC

InChI

InChI=1S/C23H27N5O4/c1-27-6-8-28(9-7-27)10-11-30-21-13-18-16(12-20(21)29-2)23(25-14-24-18)26-17-4-3-5-19-22(17)32-15-31-19/h3-5,12-14H,6-11,15H2,1-2H3,(H,24,25,26)