N-cyclopropyl-N-[[7-methoxy-2-[methyl-[(2-methyl-1,3-thiazol-4-yl)methyl]amino]quinolin-3-yl]methyl]-1-methyl-piperidin-1-ium-4-carboxamide

Systemtic Name: N-cyclopropyl-N-[[7-methoxy-2-[methyl-[(2-methyl-1,3-thiazol-4-yl)methyl]amino]quinolin-3-yl]methyl]-1-methyl-piperidin-1-ium-4-carboxamide Openeye Name: N-cyclopropyl-N-[[7-methoxy-2-[methyl-[(2-methylthiazol-4-yl)methyl]amino]-3-quinolyl]methyl]-1-methyl-piperidin-1-ium-4-carboxamide CAS Name: N-cyclopropyl-N-[[7-methoxy-2-[methyl-[(2-methyl-4-thiazolyl)methyl]amino]-3-quinolinyl]methyl]-1-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: N-cyclopropyl-N-[[7-methoxy-2-[methyl-[(2-methyl-1,3-thiazol-4-yl)methyl]amino]quinolin-3-yl]methyl]-1-methylpiperidin-1-ium-4-carboxamide Traditional Name: N-cyclopropyl-N-[[7-methoxy-2-[methyl-[(2-methylthiazol-4-yl)methyl]amino]-3-quinolyl]methyl]-1-methyl-piperidin-1-ium-4-carboxamide Formula: C27H36N5O2S+ MolecularWeight: 494.67204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN(C)C2=C(C=C3C=CC(=CC3=N2)OC)CN(C4CC4)C(=O)C5CC[NH+](CC5)C

Isomeric SMILES

CC1=NC(=CS1)CN(C)C2=C(C=C3C=CC(=CC3=N2)OC)CN(C4CC4)C(=O)C5CC[NH+](CC5)C

InChI

InChI=1S/C27H35N5O2S/c1-18-28-22(17-35-18)16-31(3)26-21(13-20-5-8-24(34-4)14-25(20)29-26)15-32(23-6-7-23)27(33)19-9-11-30(2)12-10-19/h5,8,13-14,17,19,23H,6-7,9-12,15-16H2,1-4H3/p+1