N-butyl-9-[[2-methoxy-4-(propylsulfonylamino)phenyl]amino]acridine-4-carboxamide hydrochloride

Systemtic Name: N-butyl-9-[[2-methoxy-4-(propylsulfonylamino)phenyl]amino]acridine-4-carboxamide hydrochloride Openeye Name: N-butyl-9-[2-methoxy-4-(propylsulfonylamino)anilino]acridine-4-carboxamide hydrochloride CAS Name: N-butyl-9-[2-methoxy-4-(propylsulfonylamino)anilino]-4-acridinecarboxamide hydrochloride IUPAC Name: N-butyl-9-[2-methoxy-4-(propylsulfonylamino)anilino]acridine-4-carboxamide hydrochloride Traditional Name: N-butyl-9-[2-methoxy-4-(propylsulfonylamino)anilino]acridine-4-carboxamide hydrochloride Formula: C28H33ClN4O4S MolecularWeight: 557.10402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC2=C(C3=CC=CC=C3N=C21)NC4=C(C=C(C=C4)NS(=O)(=O)CCC)OC.Cl

Isomeric SMILES

CCCCNC(=O)C1=CC=CC2=C(C3=CC=CC=C3N=C21)NC4=C(C=C(C=C4)NS(=O)(=O)CCC)OC.Cl

InChI

InChI=1S/C28H32N4O4S.ClH/c1-4-6-16-29-28(33)22-12-9-11-21-26(20-10-7-8-13-23(20)30-27(21)22)31-24-15-14-19(18-25(24)36-3)32-37(34,35)17-5-2;/h7-15,18,32H,4-6,16-17H2,1-3H3,(H,29,33)(H,30,31);1H