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

Systemtic Name: N-tert-butyl-2-[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]ethanamide Openeye Name: N-tert-butyl-2-[[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methyl-amino]acetamide CAS Name: N-tert-butyl-2-[[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-methylamino]acetamide IUPAC Name: N-tert-butyl-2-[[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methylamino]acetamide Traditional Name: N-tert-butyl-2-[[2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]acetyl]-methyl-amino]acetamide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)CSC1=NN(C(=N1)C2CC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)CSC1=NN(C(=N1)C2CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H27N5O2S/c1-20(2,3)22-16(26)12-24(4)17(27)13-28-19-21-18(14-10-11-14)25(23-19)15-8-6-5-7-9-15/h5-9,14H,10-13H2,1-4H3,(H,22,26)