2-[[4-azanyl-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-tert-butyl-ethanamide

Systemtic Name: 2-[[4-azanyl-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-tert-butyl-ethanamide Openeye Name: 2-[[4-amino-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-tert-butyl-acetamide CAS Name: 2-[[4-amino-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]thio]-N-tert-butylacetamide IUPAC Name: 2-[[4-amino-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-tert-butylacetamide Traditional Name: 2-[(4-amino-5-p-anisyl-1,2,4-triazol-3-yl)thio]-N-tert-butyl-acetamide Formula: C16H23N5O2S MolecularWeight: 349.45112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CSC1=NN=C(N1N)CC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)NC(=O)CSC1=NN=C(N1N)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H23N5O2S/c1-16(2,3)18-14(22)10-24-15-20-19-13(21(15)17)9-11-5-7-12(23-4)8-6-11/h5-8H,9-10,17H2,1-4H3,(H,18,22)