3-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[(4-tert-butylphenyl)methylthio]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(4-tert-butylphenyl)methylsulfanyl]-4-cyclopropyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[(4-tert-butylbenzyl)thio]-4-cyclopropyl-1,2,4-triazol-3-yl]propionamide Formula: C19H26N4OS MolecularWeight: 358.50094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(N2C3CC3)CCC(=O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(N2C3CC3)CCC(=O)N

InChI

InChI=1S/C19H26N4OS/c1-19(2,3)14-6-4-13(5-7-14)12-25-18-22-21-17(11-10-16(20)24)23(18)15-8-9-15/h4-7,15H,8-12H2,1-3H3,(H2,20,24)