3-bromanyl-N2-[3-(4-methylpiperazin-1-yl)propyl]-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine

Systemtic Name: 3-bromanyl-N2-[3-(4-methylpiperazin-1-yl)propyl]-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine Openeye Name: 3-bromo-N2-[3-(4-methylpiperazin-1-yl)propyl]-N1-pyrido[4,3-d]pyrimidin-4-yl-benzene-1,2-diamine CAS Name: 3-bromo-N2-[3-(4-methyl-1-piperazinyl)propyl]-N1-(4-pyrido[4,3-d]pyrimidinyl)benzene-1,2-diamine IUPAC Name: 3-bromo-2-N-[3-(4-methylpiperazin-1-yl)propyl]-1-N-pyrido[4,3-d]pyrimidin-4-ylbenzene-1,2-diamine Traditional Name: [3-bromo-2-[3-(4-methylpiperazino)propylamino]phenyl]-pyrido[4,3-d]pyrimidin-4-yl-amine Formula: C21H26BrN7 MolecularWeight: 456.38204

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC2=C(C=CC=C2Br)NC3=NC=NC4=C3C=NC=C4

Isomeric SMILES

CN1CCN(CC1)CCCNC2=C(C=CC=C2Br)NC3=NC=NC4=C3C=NC=C4

InChI

InChI=1S/C21H26BrN7/c1-28-10-12-29(13-11-28)9-3-7-24-20-17(22)4-2-5-19(20)27-21-16-14-23-8-6-18(16)25-15-26-21/h2,4-6,8,14-15,24H,3,7,9-13H2,1H3,(H,25,26,27)