N-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]-N-cyclohexyl-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]-N-cyclohexyl-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(2,5-dioxo-1-phenyl-pyrrolidin-3-yl)acetamide CAS Name: N-cyclohexyl-2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(2,5-dioxo-1-phenyl-3-pyrrolidinyl)acetamide IUPAC Name: N-cyclohexyl-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(2,5-dioxo-1-phenylpyrrolidin-3-yl)acetamide Traditional Name: N-cyclohexyl-N-(2,5-diketo-1-phenyl-pyrrolidin-3-yl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N(C2CCCCC2)C3CC(=O)N(C3=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N(C2CCCCC2)C3CC(=O)N(C3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C24H28N4O3S/c1-16-13-17(2)26-24(25-16)32-15-22(30)27(18-9-5-3-6-10-18)20-14-21(29)28(23(20)31)19-11-7-4-8-12-19/h4,7-8,11-13,18,20H,3,5-6,9-10,14-15H2,1-2H3