N-(4-chloranyl-2-methyl-phenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-(4-chloranyl-2-methyl-phenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-(4-chloro-2-methyl-phenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-(4-chloro-2-methylphenyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-(4-chloro-2-methylphenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-(4-chloro-2-methyl-phenyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]coumarilamide Formula: C19H15ClN4O2S MolecularWeight: 398.866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC=NN4

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC=NN4

InChI

InChI=1S/C19H15ClN4O2S/c1-11-8-12(20)6-7-15(11)23-18(25)17-14(9-27-19-21-10-22-24-19)13-4-2-3-5-16(13)26-17/h2-8,10H,9H2,1H3,(H,23,25)(H,21,22,24)