(4,6-dimethyl-3-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridin-5-yl)methylazanium

Systemtic Name: (4,6-dimethyl-3-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridin-5-yl)methylazanium Openeye Name: [4,6-dimethyl-3-(2-thienyl)isoxazolo[5,4-b]pyridin-5-yl]methylammonium CAS Name: (4,6-dimethyl-3-thiophen-2-yl-5-isoxazolo[5,4-b]pyridinyl)methylammonium IUPAC Name: (4,6-dimethyl-3-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridin-5-yl)methylazanium Traditional Name: [4,6-dimethyl-3-(2-thienyl)isoxazolo[5,4-b]pyridin-5-yl]methylammonium Formula: C13H14N3OS+ MolecularWeight: 260.33476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NOC2=NC(=C1C[NH3+])C)C3=CC=CS3

Isomeric SMILES

CC1=C2C(=NOC2=NC(=C1C[NH3+])C)C3=CC=CS3

InChI

InChI=1S/C13H13N3OS/c1-7-9(6-14)8(2)15-13-11(7)12(16-17-13)10-4-3-5-18-10/h3-5H,6,14H2,1-2H3/p+1