1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-5-pyridin-2-yl-3H-1,3,4-benzotriazepin-2-one

Systemtic Name: 1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-5-pyridin-2-yl-3H-1,3,4-benzotriazepin-2-one Openeye Name: 1-(2-oxo-2-pyrrolidin-1-yl-ethyl)-5-(2-pyridyl)-3H-1,3,4-benzotriazepin-2-one CAS Name: 1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-5-(2-pyridinyl)-3H-1,3,4-benzotriazepin-2-one IUPAC Name: 1-(2-oxo-2-pyrrolidin-1-ylethyl)-5-pyridin-2-yl-3H-1,3,4-benzotriazepin-2-one Traditional Name: 1-(2-keto-2-pyrrolidino-ethyl)-5-(2-pyridyl)-3H-1,3,4-benzotriazepin-2-one Formula: C19H19N5O2 MolecularWeight: 349.38646

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C3=CC=CC=C3C(=NNC2=O)C4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)C(=O)CN2C3=CC=CC=C3C(=NNC2=O)C4=CC=CC=N4

InChI

InChI=1S/C19H19N5O2/c25-17(23-11-5-6-12-23)13-24-16-9-2-1-7-14(16)18(21-22-19(24)26)15-8-3-4-10-20-15/h1-4,7-10H,5-6,11-13H2,(H,22,26)