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

Systemtic Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)propan-1-one Openeye Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)propan-1-one CAS Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-(1H-indol-3-yl)-1-propanone IUPAC Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)propan-1-one Traditional Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-(1H-indol-3-yl)propan-1-one Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)SC3=NN=C(N3C4=CC=CC=C4)C5CC5

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)SC3=NN=C(N3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C22H20N4OS/c1-14(20(27)18-13-23-19-10-6-5-9-17(18)19)28-22-25-24-21(15-11-12-15)26(22)16-7-3-2-4-8-16/h2-10,13-15,23H,11-12H2,1H3/t14-/m1/s1