5-chloranyl-3-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: 5-chloro-3-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]benzofuran-2-carboxamide CAS Name: 5-chloro-3-methyl-N-[4-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: 5-chloro-3-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: 5-chloro-3-methyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]coumarilamide Formula: C21H18ClN5O3 MolecularWeight: 423.85232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)NC(=O)C(C)N4C=NC=N4

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)NC(=O)C(C)N4C=NC=N4

InChI

InChI=1S/C21H18ClN5O3/c1-12-17-9-14(22)3-8-18(17)30-19(12)21(29)26-16-6-4-15(5-7-16)25-20(28)13(2)27-11-23-10-24-27/h3-11,13H,1-2H3,(H,25,28)(H,26,29)