N4-(3-bromophenyl)-7-[3-(1-methylpiperidin-4-yl)propoxy]quinazoline-4,6-diamine

Systemtic Name: N4-(3-bromophenyl)-7-[3-(1-methylpiperidin-4-yl)propoxy]quinazoline-4,6-diamine Openeye Name: N4-(3-bromophenyl)-7-[3-(1-methyl-4-piperidyl)propoxy]quinazoline-4,6-diamine CAS Name: N4-(3-bromophenyl)-7-[3-(1-methyl-4-piperidinyl)propoxy]quinazoline-4,6-diamine IUPAC Name: 4-N-(3-bromophenyl)-7-[3-(1-methylpiperidin-4-yl)propoxy]quinazoline-4,6-diamine Traditional Name: [6-amino-7-[3-(1-methyl-4-piperidyl)propoxy]quinazolin-4-yl]-(3-bromophenyl)amine Formula: C23H28BrN5O MolecularWeight: 470.40532

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)N

Isomeric SMILES

CN1CCC(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)N

InChI

InChI=1S/C23H28BrN5O/c1-29-9-7-16(8-10-29)4-3-11-30-22-14-21-19(13-20(22)25)23(27-15-26-21)28-18-6-2-5-17(24)12-18/h2,5-6,12-16H,3-4,7-11,25H2,1H3,(H,26,27,28)