1-[2,4-bis(chloranyl)-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonyl-N-[(5-carbamimidoylpyridin-2-yl)methyl]pyrrolidine-2-carboxamide dihydrochloride

Systemtic Name: 1-[2,4-bis(chloranyl)-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonyl-N-[(5-carbamimidoylpyridin-2-yl)methyl]pyrrolidine-2-carboxamide dihydrochloride Openeye Name: N-[(5-carbamimidoyl-2-pyridyl)methyl]-1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolyl)oxymethyl]phenyl]sulfonyl-pyrrolidine-2-carboxamide dihydrochloride CAS Name: N-[(5-carbamimidoyl-2-pyridinyl)methyl]-1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolinyl)oxymethyl]phenyl]sulfonyl-2-pyrrolidinecarboxamide dihydrochloride IUPAC Name: N-[(5-carbamimidoylpyridin-2-yl)methyl]-1-[2,4-dichloro-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidine-2-carboxamide dihydrochloride Traditional Name: N-[(5-amidino-2-pyridyl)methyl]-1-[2,4-dichloro-3-[(2,4-dimethyl-8-quinolyl)oxymethyl]phenyl]sulfonyl-pyrrolidine-2-carboxamide dihydrochloride Formula: C30H32Cl4N6O4S MolecularWeight: 714.48988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)N4CCCC4C(=O)NCC5=NC=C(C=C5)C(=N)N)Cl)C.Cl.Cl

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)N4CCCC4C(=O)NCC5=NC=C(C=C5)C(=N)N)Cl)C.Cl.Cl

InChI

InChI=1S/C30H30Cl2N6O4S.2ClH/c1-17-13-18(2)37-28-21(17)5-3-7-25(28)42-16-22-23(31)10-11-26(27(22)32)43(40,41)38-12-4-6-24(38)30(39)36-15-20-9-8-19(14-35-20)29(33)34;;/h3,5,7-11,13-14,24H,4,6,12,15-16H2,1-2H3,(H3,33,34)(H,36,39);2*1H