1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-[(2S)-2-methylindolin-1-yl]-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-[(2S)-2-methylindolin-1-yl]-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]ethanone Formula: C18H17N5OS MolecularWeight: 351.42548

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CSC3=NNC(=N3)C4=CC=NC=C4

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=O)CSC3=NNC(=N3)C4=CC=NC=C4

InChI

InChI=1S/C18H17N5OS/c1-12-10-14-4-2-3-5-15(14)23(12)16(24)11-25-18-20-17(21-22-18)13-6-8-19-9-7-13/h2-9,12H,10-11H2,1H3,(H,20,21,22)/t12-/m0/s1