6-[[[1-[2-(3-chloranyl-6-methoxy-quinolin-4-yl)ethyl]-4-(hydroxymethyl)piperidin-4-yl]amino]methyl]-4H-pyrido[3,2-b][1,4]thiazin-3-one trihydrochloride

Systemtic Name: 6-[[[1-[2-(3-chloranyl-6-methoxy-quinolin-4-yl)ethyl]-4-(hydroxymethyl)piperidin-4-yl]amino]methyl]-4H-pyrido[3,2-b][1,4]thiazin-3-one trihydrochloride Openeye Name: 6-[[[1-[2-(3-chloro-6-methoxy-4-quinolyl)ethyl]-4-(hydroxymethyl)-4-piperidyl]amino]methyl]-4H-pyrido[3,2-b][1,4]thiazin-3-one trihydrochloride CAS Name: 6-[[[1-[2-(3-chloro-6-methoxy-4-quinolinyl)ethyl]-4-(hydroxymethyl)-4-piperidinyl]amino]methyl]-4H-pyrido[3,2-b][1,4]thiazin-3-one trihydrochloride IUPAC Name: 6-[[[1-[2-(3-chloro-6-methoxyquinolin-4-yl)ethyl]-4-(hydroxymethyl)piperidin-4-yl]amino]methyl]-4H-pyrido[3,2-b][1,4]thiazin-3-one trihydrochloride Traditional Name: 6-[[[1-[2-(3-chloro-6-methoxy-4-quinolyl)ethyl]-4-methylol-4-piperidyl]amino]methyl]-4H-pyrido[3,2-b][1,4]thiazin-3-one trihydrochloride Formula: C26H33Cl4N5O3S MolecularWeight: 637.44892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=CN=C2C=C1)Cl)CCN3CCC(CC3)(CO)NCC4=NC5=C(C=C4)SCC(=O)N5.Cl.Cl.Cl

Isomeric SMILES

COC1=CC2=C(C(=CN=C2C=C1)Cl)CCN3CCC(CC3)(CO)NCC4=NC5=C(C=C4)SCC(=O)N5.Cl.Cl.Cl

InChI

InChI=1S/C26H30ClN5O3S.3ClH/c1-35-18-3-4-22-20(12-18)19(21(27)14-28-22)6-9-32-10-7-26(16-33,8-11-32)29-13-17-2-5-23-25(30-17)31-24(34)15-36-23;;;/h2-5,12,14,29,33H,6-11,13,15-16H2,1H3,(H,30,31,34);3*1H