N-(2-oxidanylideneazepan-3-yl)-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-(2-oxidanylideneazepan-3-yl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-(2-oxoazepan-3-yl)-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-(2-oxo-3-azepanyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-(2-oxoazepan-3-yl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-(2-ketoazepan-3-yl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C16H19N5O2 MolecularWeight: 313.35436

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C16H19N5O2/c22-15(20-14-3-1-2-8-18-16(14)23)13-6-4-12(5-7-13)9-21-11-17-10-19-21/h4-7,10-11,14H,1-3,8-9H2,(H,18,23)(H,20,22)