[2-(cyclohexylamino)pyridin-1-ium-1-yl]-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone

Systemtic Name: [2-(cyclohexylamino)pyridin-1-ium-1-yl]-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone Openeye Name: [2-(cyclohexylamino)pyridin-1-ium-1-yl]-[4-methyl-2-(2-pyridyl)thiazol-5-yl]methanone CAS Name: [2-(cyclohexylamino)-1-pyridin-1-iumyl]-[4-methyl-2-(2-pyridinyl)-5-thiazolyl]methanone IUPAC Name: [2-(cyclohexylamino)pyridin-1-ium-1-yl]-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone Traditional Name: [2-(cyclohexylamino)pyridin-1-ium-1-yl]-[4-methyl-2-(2-pyridyl)thiazol-5-yl]methanone Formula: C21H23N4OS+ MolecularWeight: 379.49852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=N2)C(=O)[N+]3=CC=CC=C3NC4CCCCC4

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=N2)C(=O)[N+]3=CC=CC=C3NC4CCCCC4

InChI

InChI=1S/C21H22N4OS/c1-15-19(27-20(23-15)17-11-5-7-13-22-17)21(26)25-14-8-6-12-18(25)24-16-9-3-2-4-10-16/h5-8,11-14,16H,2-4,9-10H2,1H3/p+1