N-(5-bromanyl-1,3-benzodioxol-4-yl)-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-amine

Systemtic Name: N-(5-bromanyl-1,3-benzodioxol-4-yl)-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-amine Openeye Name: N-(5-bromo-1,3-benzodioxol-4-yl)-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-amine CAS Name: N-(5-bromo-1,3-benzodioxol-4-yl)-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-4-quinazolinamine IUPAC Name: N-(5-bromo-1,3-benzodioxol-4-yl)-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-amine Traditional Name: (5-bromo-1,3-benzodioxol-4-yl)-[6-methoxy-7-[3-(4-methylpiperazino)propoxy]quinazolin-4-yl]amine Formula: C24H28BrN5O4 MolecularWeight: 530.41422

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=C(C=CC5=C4OCO5)Br)OC

Isomeric SMILES

CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=C(C=CC5=C4OCO5)Br)OC

InChI

InChI=1S/C24H28BrN5O4/c1-29-7-9-30(10-8-29)6-3-11-32-21-13-18-16(12-20(21)31-2)24(27-14-26-18)28-22-17(25)4-5-19-23(22)34-15-33-19/h4-5,12-14H,3,6-11,15H2,1-2H3,(H,26,27,28)