N-[4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl]-5-oxidanylidene-1-(2-thiophen-2-ylethyl)pyrrolidine-3-carboxamide

Systemtic Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl]-5-oxidanylidene-1-(2-thiophen-2-ylethyl)pyrrolidine-3-carboxamide Openeye Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl]-5-oxo-1-[2-(2-thienyl)ethyl]pyrrolidine-3-carboxamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)amino]phenyl]-5-oxo-1-(2-thiophen-2-ylethyl)-3-pyrrolidinecarboxamide IUPAC Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl]-5-oxo-1-(2-thiophen-2-ylethyl)pyrrolidine-3-carboxamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl]-5-keto-1-[2-(2-thienyl)ethyl]pyrrolidine-3-carboxamide Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3CC(=O)N(C3)CCC4=CC=CS4)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3CC(=O)N(C3)CCC4=CC=CS4)C

InChI

InChI=1S/C23H25N5O2S/c1-15-12-16(2)25-23(24-15)27-19-7-5-18(6-8-19)26-22(30)17-13-21(29)28(14-17)10-9-20-4-3-11-31-20/h3-8,11-12,17H,9-10,13-14H2,1-2H3,(H,26,30)(H,24,25,27)