2-pyridin-4-yl-5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-b]azepine

Systemtic Name: 2-pyridin-4-yl-5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-b]azepine Openeye Name: 2-(4-pyridyl)-5,6,7,8-tetrahydro-4H-thiazolo[4,5-b]azepine CAS Name: 2-pyridin-4-yl-5,6,7,8-tetrahydro-4H-thiazolo[4,5-b]azepine IUPAC Name: 2-pyridin-4-yl-5,6,7,8-tetrahydro-4H-[1,3]thiazolo[4,5-b]azepine Traditional Name: 2-(4-pyridyl)-5,6,7,8-tetrahydro-4H-thiazol[4,5-b]azepine Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC2=C(C1)SC(=N2)C3=CC=NC=C3

Isomeric SMILES

C1CCNC2=C(C1)SC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C12H13N3S/c1-2-6-14-11-10(3-1)16-12(15-11)9-4-7-13-8-5-9/h4-5,7-8,14H,1-3,6H2