N-[4-(acridin-9-ylamino)phenyl]-2-(quinazolin-4-ylamino)ethanesulfonamide dihydrochloride

Systemtic Name: N-[4-(acridin-9-ylamino)phenyl]-2-(quinazolin-4-ylamino)ethanesulfonamide dihydrochloride Openeye Name: N-[4-(acridin-9-ylamino)phenyl]-2-(quinazolin-4-ylamino)ethanesulfonamide dihydrochloride CAS Name: N-[4-(9-acridinylamino)phenyl]-2-(4-quinazolinylamino)ethanesulfonamide dihydrochloride IUPAC Name: N-[4-(acridin-9-ylamino)phenyl]-2-(quinazolin-4-ylamino)ethanesulfonamide dihydrochloride Traditional Name: N-[4-(acridin-9-ylamino)phenyl]-2-(quinazolin-4-ylamino)ethanesulfonamide dihydrochloride Formula: C29H26Cl2N6O2S MolecularWeight: 593.52674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)NS(=O)(=O)CCNC5=NC=NC6=CC=CC=C65.Cl.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)NS(=O)(=O)CCNC5=NC=NC6=CC=CC=C65.Cl.Cl

InChI

InChI=1S/C29H24N6O2S.2ClH/c36-38(37,18-17-30-29-24-9-3-4-10-25(24)31-19-32-29)35-21-15-13-20(14-16-21)33-28-22-7-1-5-11-26(22)34-27-12-6-2-8-23(27)28;;/h1-16,19,35H,17-18H2,(H,33,34)(H,30,31,32);2*1H