(2R)-1-(2,3-dihydro-1H-inden-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one

Systemtic Name: (2R)-1-(2,3-dihydro-1H-inden-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one Openeye Name: (2R)-1-indan-5-yl-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one CAS Name: (2R)-1-(2,3-dihydro-1H-inden-5-yl)-2-(1H-1,2,4-triazol-5-ylthio)-1-propanone IUPAC Name: (2R)-1-(2,3-dihydro-1H-inden-5-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one Traditional Name: (2R)-1-indan-5-yl-2-(1H-1,2,4-triazol-5-ylthio)propan-1-one Formula: C14H15N3OS MolecularWeight: 273.3534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(CCC2)C=C1)SC3=NC=NN3

Isomeric SMILES

C[C@H](C(=O)C1=CC2=C(CCC2)C=C1)SC3=NC=NN3

InChI

InChI=1S/C14H15N3OS/c1-9(19-14-15-8-16-17-14)13(18)12-6-5-10-3-2-4-11(10)7-12/h5-9H,2-4H2,1H3,(H,15,16,17)/t9-/m1/s1