N-[5-[2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-2-oxidanyl-phenyl]ethanamide

Systemtic Name: N-[5-[2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-2-oxidanyl-phenyl]ethanamide Openeye Name: N-[5-[2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-2-hydroxy-phenyl]acetamide CAS Name: N-[5-[2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-2-hydroxyphenyl]acetamide IUPAC Name: N-[5-[2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-2-hydroxyphenyl]acetamide Traditional Name: N-[5-[2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetyl]-2-hydroxy-phenyl]acetamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4)O

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4)O

InChI

InChI=1S/C21H20N4O3S/c1-13(26)22-17-11-15(9-10-18(17)27)19(28)12-29-21-24-23-20(14-7-8-14)25(21)16-5-3-2-4-6-16/h2-6,9-11,14,27H,7-8,12H2,1H3,(H,22,26)