N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-3,4-dihydro-1H-isothiochromen-4-amine

Systemtic Name: N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-3,4-dihydro-1H-isothiochromen-4-amine Openeye Name: N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)isothiochroman-4-amine CAS Name: N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-3,4-dihydro-1H-2-benzothiopyran-4-amine IUPAC Name: N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-3,4-dihydro-1H-isothiochromen-4-amine Traditional Name: isothiochroman-4-yl([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)amine Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2CS1)NCC3=NN=C4N3C=CC=C4

Isomeric SMILES

C1C(C2=CC=CC=C2CS1)NCC3=NN=C4N3C=CC=C4

InChI

InChI=1S/C16H16N4S/c1-2-6-13-12(5-1)10-21-11-14(13)17-9-16-19-18-15-7-3-4-8-20(15)16/h1-8,14,17H,9-11H2