2-[2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(2-ethylphenyl)ethanamide

Systemtic Name: 2-[2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(2-ethylphenyl)ethanamide Openeye Name: 2-[[2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-N-(2-ethylphenyl)acetamide CAS Name: 2-[[2-[[4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-N-(2-ethylphenyl)acetamide IUPAC Name: 2-[[2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-(2-ethylphenyl)acetamide Traditional Name: 2-[[2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]-N-(2-ethylphenyl)acetamide Formula: C22H24N6O2S MolecularWeight: 436.52996

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)CSC2=NN=C(N2C3CC3)C4=CN=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)CSC2=NN=C(N2C3CC3)C4=CN=CC=C4

InChI

InChI=1S/C22H24N6O2S/c1-2-15-6-3-4-8-18(15)25-19(29)13-24-20(30)14-31-22-27-26-21(28(22)17-9-10-17)16-7-5-11-23-12-16/h3-8,11-12,17H,2,9-10,13-14H2,1H3,(H,24,30)(H,25,29)