isoquinolin-5-ylmethyl-methyl-[(6-piperidin-1-ylcarbonylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]azanium

Systemtic Name: isoquinolin-5-ylmethyl-methyl-[(6-piperidin-1-ylcarbonylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]azanium Openeye Name: 5-isoquinolylmethyl-methyl-[[6-(piperidine-1-carbonyl)imidazo[2,1-b]thiazol-5-yl]methyl]ammonium CAS Name: 5-isoquinolinylmethyl-methyl-[[6-[oxo(1-piperidinyl)methyl]-5-imidazo[2,1-b]thiazolyl]methyl]ammonium IUPAC Name: isoquinolin-5-ylmethyl-methyl-[[6-(piperidine-1-carbonyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]azanium Traditional Name: 5-isoquinolylmethyl-methyl-[[6-(piperidine-1-carbonyl)imidazo[2,1-b]thiazol-5-yl]methyl]ammonium Formula: C23H26N5OS+ MolecularWeight: 420.55044

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC2=C1C=CN=C2)CC3=C(N=C4N3C=CS4)C(=O)N5CCCCC5

Isomeric SMILES

C[NH+](CC1=CC=CC2=C1C=CN=C2)CC3=C(N=C4N3C=CS4)C(=O)N5CCCCC5

InChI

InChI=1S/C23H25N5OS/c1-26(15-18-7-5-6-17-14-24-9-8-19(17)18)16-20-21(25-23-28(20)12-13-30-23)22(29)27-10-3-2-4-11-27/h5-9,12-14H,2-4,10-11,15-16H2,1H3/p+1