(2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1,2-diphenyl-ethanone

Systemtic Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1,2-diphenyl-ethanone Openeye Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1,2-diphenyl-ethanone CAS Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1,2-diphenylethanone IUPAC Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-1,2-diphenylethanone Traditional Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-1,2-diphenyl-ethanone Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SC(C4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)S[C@H](C4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C22H21N3OS/c26-19(15-7-3-1-4-8-15)20(16-9-5-2-6-10-16)27-22-24-23-21(17-11-12-17)25(22)18-13-14-18/h1-10,17-18,20H,11-14H2/t20-/m1/s1