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

Systemtic Name: 1-[2,4-bis(chloranyl)-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]sulfonyl-N-[(4-carbamimidoylphenyl)methyl]pyrrolidine-2-carboxamide dihydrochloride Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-1-[2,4-dichloro-3-[(2-methyl-8-quinolyl)oxymethyl]phenyl]sulfonyl-pyrrolidine-2-carboxamide dihydrochloride CAS Name: N-[(4-carbamimidoylphenyl)methyl]-1-[2,4-dichloro-3-[(2-methyl-8-quinolinyl)oxymethyl]phenyl]sulfonyl-2-pyrrolidinecarboxamide dihydrochloride IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-1-[2,4-dichloro-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidine-2-carboxamide dihydrochloride Traditional Name: N-(4-amidinobenzyl)-1-[2,4-dichloro-3-[(2-methyl-8-quinolyl)oxymethyl]phenyl]sulfonyl-pyrrolidine-2-carboxamide dihydrochloride Formula: C30H31Cl4N5O4S MolecularWeight: 699.47524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)N4CCCC4C(=O)NCC5=CC=C(C=C5)C(=N)N)Cl)C=C1.Cl.Cl

Isomeric SMILES

CC1=NC2=C(C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)N4CCCC4C(=O)NCC5=CC=C(C=C5)C(=N)N)Cl)C=C1.Cl.Cl

InChI

InChI=1S/C30H29Cl2N5O4S.2ClH/c1-18-7-10-20-4-2-6-25(28(20)36-18)41-17-22-23(31)13-14-26(27(22)32)42(39,40)37-15-3-5-24(37)30(38)35-16-19-8-11-21(12-9-19)29(33)34;;/h2,4,6-14,24H,3,5,15-17H2,1H3,(H3,33,34)(H,35,38);2*1H