4-[6-(acridin-9-ylamino)hexylsulfanylmethyl]acridin-9-amine dihydrochloride

Systemtic Name: 4-[6-(acridin-9-ylamino)hexylsulfanylmethyl]acridin-9-amine dihydrochloride Openeye Name: 4-[6-(acridin-9-ylamino)hexylsulfanylmethyl]acridin-9-amine dihydrochloride CAS Name: 4-[[6-(9-acridinylamino)hexylthio]methyl]-9-acridinamine dihydrochloride IUPAC Name: 4-[6-(acridin-9-ylamino)hexylsulfanylmethyl]acridin-9-amine dihydrochloride Traditional Name: acridin-9-yl-[6-[(9-aminoacridin-4-yl)methylthio]hexyl]amine dihydrochloride Formula: C33H34Cl2N4S MolecularWeight: 589.62086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=C(C3=N2)CSCCCCCCNC4=C5C=CC=CC5=NC6=CC=CC=C64)N.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=C(C3=N2)CSCCCCCCNC4=C5C=CC=CC5=NC6=CC=CC=C64)N.Cl.Cl

InChI

InChI=1S/C33H32N4S.2ClH/c34-31-24-13-3-6-17-28(24)37-32-23(12-11-16-27(31)32)22-38-21-10-2-1-9-20-35-33-25-14-4-7-18-29(25)36-30-19-8-5-15-26(30)33;;/h3-8,11-19H,1-2,9-10,20-22H2,(H2,34,37)(H,35,36);2*1H