N-tert-butyl-2-[2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]ethanamide

Systemtic Name: N-tert-butyl-2-[2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]ethanamide Openeye Name: N-tert-butyl-2-[[2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-methyl-amino]acetamide CAS Name: N-tert-butyl-2-[[2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-methylamino]acetamide IUPAC Name: N-tert-butyl-2-[[2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methylamino]acetamide Traditional Name: N-tert-butyl-2-[[2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]-methyl-amino]acetamide Formula: C19H26N6O2S MolecularWeight: 402.51374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)CSC1=NN=C(N1C2CC2)C3=CC=NC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)CSC1=NN=C(N1C2CC2)C3=CC=NC=C3

InChI

InChI=1S/C19H26N6O2S/c1-19(2,3)21-15(26)11-24(4)16(27)12-28-18-23-22-17(25(18)14-5-6-14)13-7-9-20-10-8-13/h7-10,14H,5-6,11-12H2,1-4H3,(H,21,26)