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

Systemtic Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-piperidin-1-yl-ethanone Openeye Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-(1-piperidyl)ethanone CAS Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-2-phenyl-1-(1-piperidinyl)ethanone IUPAC Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-piperidin-1-ylethanone Traditional Name: (2R)-2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-2-phenyl-1-piperidino-ethanone Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)SC3=NN=C(N3C4=CC=CC=C4)C5CC5

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H](C2=CC=CC=C2)SC3=NN=C(N3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C24H26N4OS/c29-23(27-16-8-3-9-17-27)21(18-10-4-1-5-11-18)30-24-26-25-22(19-14-15-19)28(24)20-12-6-2-7-13-20/h1-2,4-7,10-13,19,21H,3,8-9,14-17H2/t21-/m1/s1