4-(4-bromanylphenoxy)-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]butanamide

Systemtic Name: 4-(4-bromanylphenoxy)-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]butanamide Openeye Name: 4-(4-bromophenoxy)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]butanamide CAS Name: 4-(4-bromophenoxy)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]butanamide IUPAC Name: 4-(4-bromophenoxy)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]butanamide Traditional Name: 4-(4-bromophenoxy)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]butyramide Formula: C18H16BrClN4O2 MolecularWeight: 435.70224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCC(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3)Br

Isomeric SMILES

C1=CC(=CC=C1OCCCC(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3)Br

InChI

InChI=1S/C18H16BrClN4O2/c19-13-3-6-15(7-4-13)26-9-1-2-18(25)23-16-10-14(20)5-8-17(16)24-12-21-11-22-24/h3-8,10-12H,1-2,9H2,(H,23,25)