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

Systemtic Name: N-(2-methoxyphenyl)-4-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]benzamide Openeye Name: N-(2-methoxyphenyl)-4-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]benzamide CAS Name: N-(2-methoxyphenyl)-4-[[1-oxo-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propyl]amino]benzamide IUPAC Name: N-(2-methoxyphenyl)-4-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]benzamide Traditional Name: N-(2-methoxyphenyl)-4-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]propanoylamino]benzamide Formula: C25H23N5O3S MolecularWeight: 473.54682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2OC)SC3=NNC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2OC)SC3=NNC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N5O3S/c1-16(34-25-28-22(29-30-25)17-8-4-3-5-9-17)23(31)26-19-14-12-18(13-15-19)24(32)27-20-10-6-7-11-21(20)33-2/h3-16H,1-2H3,(H,26,31)(H,27,32)(H,28,29,30)