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

Systemtic Name: N-(1,3-benzodioxol-4-yl)-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-4-yl)-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-4-yl)-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-4-yl)-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-amine Traditional Name: 1,3-benzodioxol-4-yl-[6-methoxy-7-[3-(4-methylpiperazino)propoxy]quinazolin-4-yl]amine Formula: C24H29N5O4 MolecularWeight: 451.51816

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=C5C(=CC=C4)OCO5)OC

Isomeric SMILES

CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=C5C(=CC=C4)OCO5)OC

InChI

InChI=1S/C24H29N5O4/c1-28-8-10-29(11-9-28)7-4-12-31-22-14-19-17(13-21(22)30-2)24(26-15-25-19)27-18-5-3-6-20-23(18)33-16-32-20/h3,5-6,13-15H,4,7-12,16H2,1-2H3,(H,25,26,27)