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

Systemtic Name: 2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-2-phenyl-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-2-phenyl-1-pyrrolidino-ethanone Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)N3CCCC3)C4=CC=CC=C4OC

Isomeric SMILES

CN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)N3CCCC3)C4=CC=CC=C4OC

InChI

InChI=1S/C22H24N4O2S/c1-25-20(17-12-6-7-13-18(17)28-2)23-24-22(25)29-19(16-10-4-3-5-11-16)21(27)26-14-8-9-15-26/h3-7,10-13,19H,8-9,14-15H2,1-2H3