N-[1-[2-[bis(azanyl)methylideneamino]ethanoyl]piperidin-4-yl]-1-[2,4-bis(chloranyl)-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]sulfonyl-pyrrolidine-2-carboxamide dihydrochloride

Systemtic Name: N-[1-[2-[bis(azanyl)methylideneamino]ethanoyl]piperidin-4-yl]-1-[2,4-bis(chloranyl)-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]sulfonyl-pyrrolidine-2-carboxamide dihydrochloride Openeye Name: 1-[2,4-dichloro-3-[(2-methyl-8-quinolyl)oxymethyl]phenyl]sulfonyl-N-[1-(2-guanidinoacetyl)-4-piperidyl]pyrrolidine-2-carboxamide dihydrochloride CAS Name: N-[1-[2-(diaminomethylideneamino)-1-oxoethyl]-4-piperidinyl]-1-[2,4-dichloro-3-[(2-methyl-8-quinolinyl)oxymethyl]phenyl]sulfonyl-2-pyrrolidinecarboxamide dihydrochloride IUPAC Name: N-[1-[2-(diaminomethylideneamino)acetyl]piperidin-4-yl]-1-[2,4-dichloro-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]sulfonylpyrrolidine-2-carboxamide dihydrochloride Traditional Name: 1-[2,4-dichloro-3-[(2-methyl-8-quinolyl)oxymethyl]phenyl]sulfonyl-N-[1-(2-guanidinoacetyl)-4-piperidyl]pyrrolidine-2-carboxamide dihydrochloride Formula: C30H37Cl4N7O5S MolecularWeight: 749.53568

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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)NC5CCN(CC5)C(=O)CN=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)NC5CCN(CC5)C(=O)CN=C(N)N)Cl)C=C1.Cl.Cl

InChI

InChI=1S/C30H35Cl2N7O5S.2ClH/c1-18-7-8-19-4-2-6-24(28(19)36-18)44-17-21-22(31)9-10-25(27(21)32)45(42,43)39-13-3-5-23(39)29(41)37-20-11-14-38(15-12-20)26(40)16-35-30(33)34;;/h2,4,6-10,20,23H,3,5,11-17H2,1H3,(H,37,41)(H4,33,34,35);2*1H