3-bromanyl-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-4-ethoxy-5-methoxy-benzamide

Systemtic Name: 3-bromanyl-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-4-ethoxy-5-methoxy-benzamide Openeye Name: 3-bromo-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-ethoxy-5-methoxy-benzamide CAS Name: 3-bromo-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-ethoxy-5-methoxybenzamide IUPAC Name: 3-bromo-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-ethoxy-5-methoxybenzamide Traditional Name: 3-bromo-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-ethoxy-5-methoxy-benzamide Formula: C18H16BrClN4O3 MolecularWeight: 451.70164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3)OC

InChI

InChI=1S/C18H16BrClN4O3/c1-3-27-17-13(19)6-11(7-16(17)26-2)18(25)23-14-8-12(20)4-5-15(14)24-10-21-9-22-24/h4-10H,3H2,1-2H3,(H,23,25)