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

Systemtic Name: 1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-[(2S)-2-methylindolin-1-yl]-2-[[4-phenyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-[[4-phenyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-[(4-phenyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-[(2S)-2-methylindolin-1-yl]-2-[(4-phenyl-5-piperidino-1,2,4-triazol-3-yl)thio]ethanone Formula: C24H27N5OS MolecularWeight: 433.56908

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CSC3=NN=C(N3C4=CC=CC=C4)N5CCCCC5

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=O)CSC3=NN=C(N3C4=CC=CC=C4)N5CCCCC5

InChI

InChI=1S/C24H27N5OS/c1-18-16-19-10-6-7-13-21(19)28(18)22(30)17-31-24-26-25-23(27-14-8-3-9-15-27)29(24)20-11-4-2-5-12-20/h2,4-7,10-13,18H,3,8-9,14-17H2,1H3/t18-/m0/s1