N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-[[4-(tetrahydrofuran-2-ylmethoxy)phenyl]methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-[[4-(2-oxolanylmethoxy)phenyl]methyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-[4-(tetrahydrofurfuryloxy)benzyl]-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

Isomeric SMILES

C1CC(OC1)COC2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

InChI

InChI=1S/C22H24N4O3S/c27-21(18-7-3-17(4-8-18)14-30-22-24-15-25-26-22)23-12-16-5-9-19(10-6-16)29-13-20-2-1-11-28-20/h3-10,15,20H,1-2,11-14H2,(H,23,27)(H,24,25,26)