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

Systemtic Name: 1-[3-[2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[3-[2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]pyrrolidin-2-one CAS Name: 1-[3-[2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[3-[2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[3-[2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]acetyl]phenyl]-2-pyrrolidone Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCC(=O)C2=CC(=CC=C2)N3CCCC3=O

Isomeric SMILES

CC1=NN=C(N1CC=C)SCC(=O)C2=CC(=CC=C2)N3CCCC3=O

InChI

InChI=1S/C18H20N4O2S/c1-3-9-21-13(2)19-20-18(21)25-12-16(23)14-6-4-7-15(11-14)22-10-5-8-17(22)24/h3-4,6-7,11H,1,5,8-10,12H2,2H3