N-[2,3-bis(oxidanyl)propyl]-9-[[2-methoxy-4-(methylsulfonylamino)phenyl]amino]acridine-4-carboxamide hydrochloride

Systemtic Name: N-[2,3-bis(oxidanyl)propyl]-9-[[2-methoxy-4-(methylsulfonylamino)phenyl]amino]acridine-4-carboxamide hydrochloride Openeye Name: N-(2,3-dihydroxypropyl)-9-[4-(methanesulfonamido)-2-methoxy-anilino]acridine-4-carboxamide hydrochloride CAS Name: N-(2,3-dihydroxypropyl)-9-[4-(methanesulfonamido)-2-methoxyanilino]-4-acridinecarboxamide hydrochloride IUPAC Name: N-(2,3-dihydroxypropyl)-9-[4-(methanesulfonamido)-2-methoxyanilino]acridine-4-carboxamide hydrochloride Traditional Name: N-glyceryl-9-[4-(methanesulfonamido)-2-methoxy-anilino]acridine-4-carboxamide hydrochloride Formula: C25H27ClN4O6S MolecularWeight: 547.02308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=C(C3=NC4=CC=CC=C42)C(=O)NCC(CO)O.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=C(C3=NC4=CC=CC=C42)C(=O)NCC(CO)O.Cl

InChI

InChI=1S/C25H26N4O6S.ClH/c1-35-22-12-15(29-36(2,33)34)10-11-21(22)28-23-17-6-3-4-9-20(17)27-24-18(23)7-5-8-19(24)25(32)26-13-16(31)14-30;/h3-12,16,29-31H,13-14H2,1-2H3,(H,26,32)(H,27,28);1H