[2-(propan-2-ylamino)pyridin-1-ium-1-yl]-[4-(1,3-thiazol-4-ylmethoxy)phenyl]methanone

Systemtic Name: [2-(propan-2-ylamino)pyridin-1-ium-1-yl]-[4-(1,3-thiazol-4-ylmethoxy)phenyl]methanone Openeye Name: [2-(isopropylamino)pyridin-1-ium-1-yl]-[4-(thiazol-4-ylmethoxy)phenyl]methanone CAS Name: [2-(propan-2-ylamino)-1-pyridin-1-iumyl]-[4-(4-thiazolylmethoxy)phenyl]methanone IUPAC Name: [2-(propan-2-ylamino)pyridin-1-ium-1-yl]-[4-(1,3-thiazol-4-ylmethoxy)phenyl]methanone Traditional Name: [2-(isopropylamino)pyridin-1-ium-1-yl]-[4-(thiazol-4-ylmethoxy)phenyl]methanone Formula: C19H20N3O2S+ MolecularWeight: 354.446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC=CC=[N+]1C(=O)C2=CC=C(C=C2)OCC3=CSC=N3

Isomeric SMILES

CC(C)NC1=CC=CC=[N+]1C(=O)C2=CC=C(C=C2)OCC3=CSC=N3

InChI

InChI=1S/C19H19N3O2S/c1-14(2)21-18-5-3-4-10-22(18)19(23)15-6-8-17(9-7-15)24-11-16-12-25-13-20-16/h3-10,12-14H,11H2,1-2H3/p+1