(2S)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1H-indol-3-yl)-2-phenyl-ethanone

Systemtic Name: (2S)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1H-indol-3-yl)-2-phenyl-ethanone Openeye Name: (2S)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1H-indol-3-yl)-2-phenyl-ethanone CAS Name: (2S)-2-[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]-1-(1H-indol-3-yl)-2-phenylethanone IUPAC Name: (2S)-2-(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanyl-1-(1H-indol-3-yl)-2-phenylethanone Traditional Name: (2S)-2-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]-1-(1H-indol-3-yl)-2-phenyl-ethanone Formula: C26H27N3OS MolecularWeight: 429.57708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43)C5CCCC5)C

Isomeric SMILES

CC1=C(N(C(=N1)S[C@@H](C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43)C5CCCC5)C

InChI

InChI=1S/C26H27N3OS/c1-17-18(2)29(20-12-6-7-13-20)26(28-17)31-25(19-10-4-3-5-11-19)24(30)22-16-27-23-15-9-8-14-21(22)23/h3-5,8-11,14-16,20,25,27H,6-7,12-13H2,1-2H3/t25-/m0/s1