2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-tert-butylphenyl)ethanone

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-tert-butylphenyl)ethanone Openeye Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1-(4-tert-butylphenyl)ethanone CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-1-(4-tert-butylphenyl)ethanone IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1-(4-tert-butylphenyl)ethanone Traditional Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-1-(4-tert-butylphenyl)ethanone Formula: C14H18N4OS MolecularWeight: 290.38392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NN=CN2N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NN=CN2N

InChI

InChI=1S/C14H18N4OS/c1-14(2,3)11-6-4-10(5-7-11)12(19)8-20-13-17-16-9-18(13)15/h4-7,9H,8,15H2,1-3H3