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

Systemtic Name: N-[5-[2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]-2-oxidanyl-phenyl]ethanamide Openeye Name: N-[5-[2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2-hydroxy-phenyl]acetamide CAS Name: N-[5-[2-[[4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-2-hydroxyphenyl]acetamide IUPAC Name: N-[5-[2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-2-hydroxyphenyl]acetamide Traditional Name: N-[5-[2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]-2-hydroxy-phenyl]acetamide Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)CSC2=NN=C(N2C3CC3)C4=CN=CC=C4)O

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)CSC2=NN=C(N2C3CC3)C4=CN=CC=C4)O

InChI

InChI=1S/C20H19N5O3S/c1-12(26)22-16-9-13(4-7-17(16)27)18(28)11-29-20-24-23-19(25(20)15-5-6-15)14-3-2-8-21-10-14/h2-4,7-10,15,27H,5-6,11H2,1H3,(H,22,26)