2-[2-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[2-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[2-[2-[(2S)-2-methylindolin-1-yl]-2-oxo-ethyl]sulfanylbenzimidazol-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[2-[[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]thio]-1-benzimidazolyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[2-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]sulfanylbenzimidazol-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[2-[[2-keto-2-[(2S)-2-methylindolin-1-yl]ethyl]thio]benzimidazol-1-yl]-1-piperidino-ethanone Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CSC3=NC4=CC=CC=C4N3CC(=O)N5CCCCC5

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=O)CSC3=NC4=CC=CC=C4N3CC(=O)N5CCCCC5

InChI

InChI=1S/C25H28N4O2S/c1-18-15-19-9-3-5-11-21(19)29(18)24(31)17-32-25-26-20-10-4-6-12-22(20)28(25)16-23(30)27-13-7-2-8-14-27/h3-6,9-12,18H,2,7-8,13-17H2,1H3/t18-/m0/s1