1-(4-methylphenyl)-3-[6-(2-methylpropyl)-3-pentanoyl-pyridin-2-yl]sulfanyl-pyrrolidine-2,5-dione

Systemtic Name: 1-(4-methylphenyl)-3-[6-(2-methylpropyl)-3-pentanoyl-pyridin-2-yl]sulfanyl-pyrrolidine-2,5-dione Openeye Name: 3-[(6-isobutyl-3-pentanoyl-2-pyridyl)sulfanyl]-1-(p-tolyl)pyrrolidine-2,5-dione CAS Name: 1-(4-methylphenyl)-3-[[6-(2-methylpropyl)-3-(1-oxopentyl)-2-pyridinyl]thio]pyrrolidine-2,5-dione IUPAC Name: 1-(4-methylphenyl)-3-[6-(2-methylpropyl)-3-pentanoylpyridin-2-yl]sulfanylpyrrolidine-2,5-dione Traditional Name: 3-[(6-isobutyl-3-valeryl-2-pyridyl)thio]-1-(p-tolyl)pyrrolidine-2,5-quinone Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=C(N=C(C=C1)CC(C)C)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC(=O)C1=C(N=C(C=C1)CC(C)C)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H30N2O3S/c1-5-6-7-21(28)20-13-10-18(14-16(2)3)26-24(20)31-22-15-23(29)27(25(22)30)19-11-8-17(4)9-12-19/h8-13,16,22H,5-7,14-15H2,1-4H3