N-(4-tert-butylphenyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(4-tert-butylphenyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(4-tert-butylphenyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(4-tert-butylphenyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(4-tert-butylphenyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(4-tert-butylphenyl)-2-[[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C18H26N4O2S MolecularWeight: 362.48964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(C)(C)C)SC2=NN=CN2CCOC

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(C)(C)C)SC2=NN=CN2CCOC

InChI

InChI=1S/C18H26N4O2S/c1-13(25-17-21-19-12-22(17)10-11-24-5)16(23)20-15-8-6-14(7-9-15)18(2,3)4/h6-9,12-13H,10-11H2,1-5H3,(H,20,23)