N-[1-(1-benzofuran-2-yl)ethyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-[1-(1-benzofuran-2-yl)ethyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[1-(benzofuran-2-yl)ethyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[1-(2-benzofuranyl)ethyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-[1-(1-benzofuran-2-yl)ethyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-[1-(benzofuran-2-yl)ethyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

Isomeric SMILES

CC(C1=CC2=CC=CC=C2O1)NC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

InChI

InChI=1S/C20H18N4O2S/c1-13(18-10-16-4-2-3-5-17(16)26-18)23-19(25)15-8-6-14(7-9-15)11-27-20-21-12-22-24-20/h2-10,12-13H,11H2,1H3,(H,23,25)(H,21,22,24)