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

Systemtic Name: 2-[[4-azanyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-tert-butyl-propanamide Openeye Name: 2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-tert-butyl-propanamide CAS Name: 2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-tert-butylpropanamide IUPAC Name: 2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-tert-butylpropanamide Traditional Name: 2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-tert-butyl-propionamide Formula: C16H23N5O2S MolecularWeight: 349.45112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)SC1=NN=C(N1N)C2=CC=CC=C2OC

Isomeric SMILES

CC(C(=O)NC(C)(C)C)SC1=NN=C(N1N)C2=CC=CC=C2OC

InChI

InChI=1S/C16H23N5O2S/c1-10(14(22)18-16(2,3)4)24-15-20-19-13(21(15)17)11-8-6-7-9-12(11)23-5/h6-10H,17H2,1-5H3,(H,18,22)