N-(2-hydroxyethyl)-4-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide

Systemtic Name: N-(2-hydroxyethyl)-4-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Openeye Name: N-(2-hydroxyethyl)-4-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide CAS Name: N-(2-hydroxyethyl)-4-[[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]benzamide IUPAC Name: N-(2-hydroxyethyl)-4-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Traditional Name: N-(2-hydroxyethyl)-4-[[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]benzamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=CC=C(C=C4)C(=O)NCCO

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=CC=C(C=C4)C(=O)NCCO

InChI

InChI=1S/C25H24N4O3S/c1-32-22-9-5-6-20(16-22)23-27-28-25(29(23)21-7-3-2-4-8-21)33-17-18-10-12-19(13-11-18)24(31)26-14-15-30/h2-13,16,30H,14-15,17H2,1H3,(H,26,31)