N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-1-(phenylcarbonyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-1-(phenylcarbonyl)pyrrolidine-2-carboxamide Openeye Name: 1-benzoyl-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]pyrrolidine-2-carboxamide CAS Name: 1-benzoyl-N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-benzoyl-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]pyrrolidine-2-carboxamide Traditional Name: 1-benzoyl-N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]pyrrolidine-2-carboxamide Formula: C24H24N4O2S MolecularWeight: 432.53796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3CCCN3C(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3CCCN3C(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C24H24N4O2S/c1-16-15-17(2)26-24(25-16)31-20-12-10-19(11-13-20)27-22(29)21-9-6-14-28(21)23(30)18-7-4-3-5-8-18/h3-5,7-8,10-13,15,21H,6,9,14H2,1-2H3,(H,27,29)