(5S)-5-tert-butyl-N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboximidate

Systemtic Name: (5S)-5-tert-butyl-N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboximidate Openeye Name: (5S)-5-tert-butyl-N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydrobenzothiophene-2-carboximidate CAS Name: (5S)-5-tert-butyl-N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboximidate IUPAC Name: (5S)-5-tert-butyl-N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboximidate Traditional Name: (5S)-5-tert-butyl-N-(1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydrobenzothiophene-2-carboximidate Formula: C15H19N4OS- MolecularWeight: 303.40256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=NC3=NC=NN3)[O-]

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=C(C1)C=C(S2)C(=NC3=NC=NN3)[O-]

InChI

InChI=1S/C15H20N4OS/c1-15(2,3)10-4-5-11-9(6-10)7-12(21-11)13(20)18-14-16-8-17-19-14/h7-8,10H,4-6H2,1-3H3,(H2,16,17,18,19,20)/p-1/t10-/m0/s1