[3-[1-(2-cyclopropylquinolin-4-yl)carbonylpiperidin-4-yl]oxyphenyl]methyl-methyl-(1,3-thiazol-2-ylmethyl)azanium

Systemtic Name: [3-[1-(2-cyclopropylquinolin-4-yl)carbonylpiperidin-4-yl]oxyphenyl]methyl-methyl-(1,3-thiazol-2-ylmethyl)azanium Openeye Name: [3-[[1-(2-cyclopropylquinoline-4-carbonyl)-4-piperidyl]oxy]phenyl]methyl-methyl-(thiazol-2-ylmethyl)ammonium CAS Name: [3-[[1-[(2-cyclopropyl-4-quinolinyl)-oxomethyl]-4-piperidinyl]oxy]phenyl]methyl-methyl-(2-thiazolylmethyl)ammonium IUPAC Name: [3-[1-(2-cyclopropylquinoline-4-carbonyl)piperidin-4-yl]oxyphenyl]methyl-methyl-(1,3-thiazol-2-ylmethyl)azanium Traditional Name: [3-[[1-(2-cyclopropylquinoline-4-carbonyl)-4-piperidyl]oxy]benzyl]-methyl-(thiazol-2-ylmethyl)ammonium Formula: C30H33N4O2S+ MolecularWeight: 513.67362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OC2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5)CC6=NC=CS6

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OC2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5CC5)CC6=NC=CS6

InChI

InChI=1S/C30H32N4O2S/c1-33(20-29-31-13-16-37-29)19-21-5-4-6-24(17-21)36-23-11-14-34(15-12-23)30(35)26-18-28(22-9-10-22)32-27-8-3-2-7-25(26)27/h2-8,13,16-18,22-23H,9-12,14-15,19-20H2,1H3/p+1