1-[4-[2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-1-oxoethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]acetyl]phenyl]-2-pyrrolidone Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SCC(=O)C2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CC1=NC(=NN1)SCC(=O)C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C15H16N4O2S/c1-10-16-15(18-17-10)22-9-13(20)11-4-6-12(7-5-11)19-8-2-3-14(19)21/h4-7H,2-3,8-9H2,1H3,(H,16,17,18)