(3S)-1-(2,3-dihydro-1H-inden-5-yl)-5-oxidanylidene-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)pyrrolidine-3-carboximidate

Systemtic Name: (3S)-1-(2,3-dihydro-1H-inden-5-yl)-5-oxidanylidene-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)pyrrolidine-3-carboximidate Openeye Name: (3S)-1-indan-5-yl-5-oxo-N-(5-thioxo-1H-1,2,4-triazol-4-yl)pyrrolidine-3-carboximidate CAS Name: (3S)-1-(2,3-dihydro-1H-inden-5-yl)-5-oxo-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)-3-pyrrolidinecarboximidate IUPAC Name: (3S)-1-(2,3-dihydro-1H-inden-5-yl)-5-oxo-N-(5-sulfanylidene-1H-1,2,4-triazol-4-yl)pyrrolidine-3-carboximidate Traditional Name: (3S)-1-indan-5-yl-5-keto-N-(5-thioxo-1H-1,2,4-triazol-4-yl)pyrrolidine-3-carboximidate Formula: C16H16N5O2S- MolecularWeight: 342.39554

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)N3CC(CC3=O)C(=NN4C=NNC4=S)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)N3C[C@H](CC3=O)C(=NN4C=NNC4=S)[O-]

InChI

InChI=1S/C16H17N5O2S/c22-14-7-12(15(23)19-21-9-17-18-16(21)24)8-20(14)13-5-4-10-2-1-3-11(10)6-13/h4-6,9,12H,1-3,7-8H2,(H,18,24)(H,19,23)/p-1/t12-/m0/s1