N-[4-(ethylcarbamoylamino)butyl]-9-[2-(methylamino)ethylamino]acridine-4-carboxamide trihydrochloride

Systemtic Name: N-[4-(ethylcarbamoylamino)butyl]-9-[2-(methylamino)ethylamino]acridine-4-carboxamide trihydrochloride Openeye Name: N-[4-(ethylcarbamoylamino)butyl]-9-[2-(methylamino)ethylamino]acridine-4-carboxamide trihydrochloride CAS Name: N-[4-(ethylcarbamoylamino)butyl]-9-[2-(methylamino)ethylamino]-4-acridinecarboxamide trihydrochloride IUPAC Name: N-[4-(ethylcarbamoylamino)butyl]-9-[2-(methylamino)ethylamino]acridine-4-carboxamide trihydrochloride Traditional Name: N-[4-(ethylcarbamoylamino)butyl]-9-[2-(methylamino)ethylamino]acridine-4-carboxamide trihydrochloride Formula: C24H35Cl3N6O2 MolecularWeight: 545.9327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NCCCCNC(=O)C1=CC=CC2=C(C3=CC=CC=C3N=C21)NCCNC.Cl.Cl.Cl

Isomeric SMILES

CCNC(=O)NCCCCNC(=O)C1=CC=CC2=C(C3=CC=CC=C3N=C21)NCCNC.Cl.Cl.Cl

InChI

InChI=1S/C24H32N6O2.3ClH/c1-3-26-24(32)29-14-7-6-13-28-23(31)19-11-8-10-18-21(27-16-15-25-2)17-9-4-5-12-20(17)30-22(18)19;;;/h4-5,8-12,25H,3,6-7,13-16H2,1-2H3,(H,27,30)(H,28,31)(H2,26,29,32);3*1H