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

Systemtic Name: 7-chloranyl-3,5-dimethyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1-benzofuran-2-carboxamide Openeye Name: 7-chloro-3,5-dimethyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]benzofuran-2-carboxamide CAS Name: 7-chloro-3,5-dimethyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-2-benzofurancarboxamide IUPAC Name: 7-chloro-3,5-dimethyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]-1-benzofuran-2-carboxamide Traditional Name: 7-chloro-3,5-dimethyl-N-[1-phenyl-3-(1,2,4-triazol-1-yl)propyl]coumarilamide Formula: C22H21ClN4O2 MolecularWeight: 408.88074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)NC(CCN3C=NC=N3)C4=CC=CC=C4)C)Cl

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)NC(CCN3C=NC=N3)C4=CC=CC=C4)C)Cl

InChI

InChI=1S/C22H21ClN4O2/c1-14-10-17-15(2)20(29-21(17)18(23)11-14)22(28)26-19(16-6-4-3-5-7-16)8-9-27-13-24-12-25-27/h3-7,10-13,19H,8-9H2,1-2H3,(H,26,28)