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

Systemtic Name: N-(4-methoxyphenyl)-4-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Openeye Name: N-(4-methoxyphenyl)-4-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide CAS Name: N-(4-methoxyphenyl)-4-[[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]methyl]benzamide IUPAC Name: N-(4-methoxyphenyl)-4-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Traditional Name: N-(4-methoxyphenyl)-4-[[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]methyl]benzamide Formula: C23H20N4O2S MolecularWeight: 416.4955

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NNC(=N3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NNC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H20N4O2S/c1-29-20-13-11-19(12-14-20)24-22(28)18-9-7-16(8-10-18)15-30-23-25-21(26-27-23)17-5-3-2-4-6-17/h2-14H,15H2,1H3,(H,24,28)(H,25,26,27)