3-ethyl-8-[3-(4-pyridin-2-ylpiperazin-1-yl)propylamino]-1H-imidazo[4,5-g]quinazoline-2-thione trihydrochloride

Systemtic Name: 3-ethyl-8-[3-(4-pyridin-2-ylpiperazin-1-yl)propylamino]-1H-imidazo[4,5-g]quinazoline-2-thione trihydrochloride Openeye Name: 3-ethyl-8-[3-[4-(2-pyridyl)piperazin-1-yl]propylamino]-1H-imidazo[4,5-g]quinazoline-2-thione trihydrochloride CAS Name: 3-ethyl-8-[3-[4-(2-pyridinyl)-1-piperazinyl]propylamino]-1H-imidazo[4,5-g]quinazoline-2-thione trihydrochloride IUPAC Name: 3-ethyl-8-[3-(4-pyridin-2-ylpiperazin-1-yl)propylamino]-1H-imidazo[4,5-g]quinazoline-2-thione trihydrochloride Traditional Name: 3-ethyl-8-[3-[4-(2-pyridyl)piperazino]propylamino]-1H-imidazo[4,5-g]quinazoline-2-thione trihydrochloride Formula: C23H31Cl3N8S MolecularWeight: 557.96984

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C3C(=C2)N=CN=C3NCCCN4CCN(CC4)C5=CC=CC=N5)NC1=S.Cl.Cl.Cl

Isomeric SMILES

CCN1C2=C(C=C3C(=C2)N=CN=C3NCCCN4CCN(CC4)C5=CC=CC=N5)NC1=S.Cl.Cl.Cl

InChI

InChI=1S/C23H28N8S.3ClH/c1-2-31-20-15-18-17(14-19(20)28-23(31)32)22(27-16-26-18)25-8-5-9-29-10-12-30(13-11-29)21-6-3-4-7-24-21;;;/h3-4,6-7,14-16H,2,5,8-13H2,1H3,(H,28,32)(H,25,26,27);3*1H