8-(methylamino)-6-pyridin-3-yl-5,8-dihydro-4H-[1,3]thiazolo[4,5-d]azepin-7-one

Systemtic Name: 8-(methylamino)-6-pyridin-3-yl-5,8-dihydro-4H-[1,3]thiazolo[4,5-d]azepin-7-one Openeye Name: 8-(methylamino)-6-(3-pyridyl)-5,8-dihydro-4H-thiazolo[4,5-d]azepin-7-one CAS Name: 8-(methylamino)-6-(3-pyridinyl)-5,8-dihydro-4H-thiazolo[4,5-d]azepin-7-one IUPAC Name: 8-(methylamino)-6-pyridin-3-yl-5,8-dihydro-4H-[1,3]thiazolo[4,5-d]azepin-7-one Traditional Name: 8-(methylamino)-6-(3-pyridyl)-5,8-dihydro-4H-thiazol[4,5-d]azepin-7-one Formula: C13H14N4OS MolecularWeight: 274.34146

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Descriptors Computed from Structure

Canonical SMILES:

CNC1C2=C(CCN(C1=O)C3=CN=CC=C3)N=CS2

Isomeric SMILES

CNC1C2=C(CCN(C1=O)C3=CN=CC=C3)N=CS2

InChI

InChI=1S/C13H14N4OS/c1-14-11-12-10(16-8-19-12)4-6-17(13(11)18)9-3-2-5-15-7-9/h2-3,5,7-8,11,14H,4,6H2,1H3