4-[2-(acridin-9-ylamino)ethylsulfanylmethyl]acridin-9-amine dihydrochloride

Systemtic Name: 4-[2-(acridin-9-ylamino)ethylsulfanylmethyl]acridin-9-amine dihydrochloride Openeye Name: 4-[2-(acridin-9-ylamino)ethylsulfanylmethyl]acridin-9-amine dihydrochloride CAS Name: 4-[[2-(9-acridinylamino)ethylthio]methyl]-9-acridinamine dihydrochloride IUPAC Name: 4-[2-(acridin-9-ylamino)ethylsulfanylmethyl]acridin-9-amine dihydrochloride Traditional Name: acridin-9-yl-[2-[(9-aminoacridin-4-yl)methylthio]ethyl]amine dihydrochloride Formula: C29H26Cl2N4S MolecularWeight: 533.51454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=C(C3=N2)CSCCNC4=C5C=CC=CC5=NC6=CC=CC=C64)N.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=C(C3=N2)CSCCNC4=C5C=CC=CC5=NC6=CC=CC=C64)N.Cl.Cl

InChI

InChI=1S/C29H24N4S.2ClH/c30-27-20-9-1-4-13-24(20)33-28-19(8-7-12-23(27)28)18-34-17-16-31-29-21-10-2-5-14-25(21)32-26-15-6-3-11-22(26)29;;/h1-15H,16-18H2,(H2,30,33)(H,31,32);2*1H