5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[3-(4-methyl-1,3-thiazol-5-yl)propyl]pyridin-1-ium-2-amine

Systemtic Name: 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[3-(4-methyl-1,3-thiazol-5-yl)propyl]pyridin-1-ium-2-amine Openeye Name: 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[3-(4-methylthiazol-5-yl)propyl]pyridin-1-ium-2-amine CAS Name: 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[3-(4-methyl-5-thiazolyl)propyl]-2-pyridin-1-iumamine IUPAC Name: 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[3-(4-methyl-1,3-thiazol-5-yl)propyl]pyridin-1-ium-2-amine Traditional Name: [5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-[3-(4-methylthiazol-5-yl)propyl]amine Formula: C17H20N5OS+ MolecularWeight: 342.4386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=N1)CCCNC2=[NH+]C=C(C=C2)C3=NC(=NO3)C4CC4

Isomeric SMILES

CC1=C(SC=N1)CCCNC2=[NH+]C=C(C=C2)C3=NC(=NO3)C4CC4

InChI

InChI=1S/C17H19N5OS/c1-11-14(24-10-20-11)3-2-8-18-15-7-6-13(9-19-15)17-21-16(22-23-17)12-4-5-12/h6-7,9-10,12H,2-5,8H2,1H3,(H,18,19)/p+1