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

Systemtic Name: 1-[4-[2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetyl]phenyl]-2-pyrrolidone Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C23H22N4O2S/c28-20(16-10-12-18(13-11-16)26-14-4-7-21(26)29)15-30-23-25-24-22(17-8-9-17)27(23)19-5-2-1-3-6-19/h1-3,5-6,10-13,17H,4,7-9,14-15H2