N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-ethanoylpiperazin-1-yl)ethanamide

Systemtic Name: N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-ethanoylpiperazin-1-yl)ethanamide Openeye Name: 2-(4-acetylpiperazin-1-yl)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]acetamide CAS Name: 2-(4-acetyl-1-piperazinyl)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]acetamide IUPAC Name: 2-(4-acetylpiperazin-1-yl)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]acetamide Traditional Name: 2-(4-acetylpiperazino)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]acetamide Formula: C16H19ClN6O2 MolecularWeight: 362.81406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3

Isomeric SMILES

CC(=O)N1CCN(CC1)CC(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3

InChI

InChI=1S/C16H19ClN6O2/c1-12(24)22-6-4-21(5-7-22)9-16(25)20-14-8-13(17)2-3-15(14)23-11-18-10-19-23/h2-3,8,10-11H,4-7,9H2,1H3,(H,20,25)