N-(1H-1,2,4-triazol-5-yl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide

Systemtic Name: N-(1H-1,2,4-triazol-5-yl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide Openeye Name: N-(1H-1,2,4-triazol-5-yl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide CAS Name: N-(1H-1,2,4-triazol-5-yl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide IUPAC Name: N-(1H-1,2,4-triazol-5-yl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide Traditional Name: N-(1H-1,2,4-triazol-5-yl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide Formula: C13H15N5O MolecularWeight: 257.2911

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C2=CC=CC=C2C1)C(=O)NC3=NC=NN3

Isomeric SMILES

C1CCN(C2=CC=CC=C2C1)C(=O)NC3=NC=NN3

InChI

InChI=1S/C13H15N5O/c19-13(16-12-14-9-15-17-12)18-8-4-3-6-10-5-1-2-7-11(10)18/h1-2,5,7,9H,3-4,6,8H2,(H2,14,15,16,17,19)