N-(2-methoxyethyl)-4-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide

Systemtic Name: N-(2-methoxyethyl)-4-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Openeye Name: N-(2-methoxyethyl)-4-[[4-(p-tolyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide CAS Name: N-(2-methoxyethyl)-4-[[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]methyl]benzamide IUPAC Name: N-(2-methoxyethyl)-4-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Traditional Name: N-(2-methoxyethyl)-4-[[[4-(p-tolyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]benzamide Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)C(=O)NCCOC)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)C(=O)NCCOC)C4=CC=NC=C4

InChI

InChI=1S/C25H25N5O2S/c1-18-3-9-22(10-4-18)30-23(20-11-13-26-14-12-20)28-29-25(30)33-17-19-5-7-21(8-6-19)24(31)27-15-16-32-2/h3-14H,15-17H2,1-2H3,(H,27,31)