1-[2-[[4-(2-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]pyrrolidin-2-one

Systemtic Name: 1-[2-[[4-(2-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]pyrrolidin-2-one Openeye Name: 1-[2-[[4-(o-tolyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]pyrrolidin-2-one CAS Name: 1-[2-[[4-(2-methylphenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-2-pyrrolidinone IUPAC Name: 1-[2-[[4-(2-methylphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]pyrrolidin-2-one Traditional Name: 1-[2-[[4-(o-tolyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]-2-pyrrolidone Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SCC(=O)N3CCCC3=O)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SCC(=O)N3CCCC3=O)C4=CN=CC=C4

InChI

InChI=1S/C20H19N5O2S/c1-14-6-2-3-8-16(14)25-19(15-7-4-10-21-12-15)22-23-20(25)28-13-18(27)24-11-5-9-17(24)26/h2-4,6-8,10,12H,5,9,11,13H2,1H3