2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydro-1H-inden-5-yl)ethanone

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydro-1H-inden-5-yl)ethanone Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-indan-5-yl-ethanone CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-(2,3-dihydro-1H-inden-5-yl)ethanone IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydro-1H-inden-5-yl)ethanone Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-indan-5-yl-ethanone Formula: C13H14N4OS MolecularWeight: 274.34146

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)CSC3=NNC(=N3)N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)CSC3=NNC(=N3)N

InChI

InChI=1S/C13H14N4OS/c14-12-15-13(17-16-12)19-7-11(18)10-5-4-8-2-1-3-9(8)6-10/h4-6H,1-3,7H2,(H3,14,15,16,17)