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

Systemtic Name: (2R)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-pyrrolidin-1-yl-ethanone Openeye Name: (2R)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-pyrrolidin-1-yl-ethanone CAS Name: (2R)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-2-phenyl-1-(1-pyrrolidinyl)ethanone IUPAC Name: (2R)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-1-pyrrolidin-1-ylethanone Traditional Name: (2R)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-2-phenyl-1-pyrrolidino-ethanone Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SC(C3=CC=CC=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)S[C@H](C3=CC=CC=C3)C(=O)N4CCCC4

InChI

InChI=1S/C21H22N4OS/c1-16-22-23-21(25(16)18-12-6-3-7-13-18)27-19(17-10-4-2-5-11-17)20(26)24-14-8-9-15-24/h2-7,10-13,19H,8-9,14-15H2,1H3/t19-/m1/s1