2-methoxy-N-[[5-(oxolan-2-ylmethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 2-methoxy-N-[[5-(oxolan-2-ylmethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: N-[[4-benzyl-5-(tetrahydrofuran-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-2-methoxy-benzamide CAS Name: 2-methoxy-N-[[5-(2-oxolanylmethylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: N-[[4-benzyl-5-(oxolan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-2-methoxybenzamide Traditional Name: N-[[4-benzyl-5-(tetrahydrofurfurylthio)-1,2,4-triazol-3-yl]methyl]-2-methoxy-benzamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2=NN=C(N2CC3=CC=CC=C3)SCC4CCCO4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2=NN=C(N2CC3=CC=CC=C3)SCC4CCCO4

InChI

InChI=1S/C23H26N4O3S/c1-29-20-12-6-5-11-19(20)22(28)24-14-21-25-26-23(31-16-18-10-7-13-30-18)27(21)15-17-8-3-2-4-9-17/h2-6,8-9,11-12,18H,7,10,13-16H2,1H3,(H,24,28)