3,5-dimethyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3,5-dimethyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1-benzofuran-2-carboxamide Openeye Name: 3,5-dimethyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]benzofuran-2-carboxamide CAS Name: 3,5-dimethyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-2-benzofurancarboxamide IUPAC Name: 3,5-dimethyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1-benzofuran-2-carboxamide Traditional Name: 3,5-dimethyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]coumarilamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C2C)C(=O)NC(CCN3C=NC=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C2C)C(=O)NC(CCN3C=NC=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2/c1-15-8-9-20-18(12-15)16(2)21(28-20)22(27)25-19(17-6-4-3-5-7-17)10-11-26-14-23-13-24-26/h3-9,12-14,19H,10-11H2,1-2H3,(H,25,27)