(2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)-2-phenyl-ethanone

Systemtic Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)-2-phenyl-ethanone Openeye Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)-2-phenyl-ethanone CAS Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-1-(1H-indol-3-yl)-2-phenylethanone IUPAC Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)-2-phenylethanone Traditional Name: (2R)-2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-1-(1H-indol-3-yl)-2-phenyl-ethanone Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43)C5CC5

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C2=CC=CC=C2)C(=O)C3=CNC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C23H22N4OS/c1-2-27-22(16-12-13-16)25-26-23(27)29-21(15-8-4-3-5-9-15)20(28)18-14-24-19-11-7-6-10-17(18)19/h3-11,14,16,21,24H,2,12-13H2,1H3/t21-/m1/s1