(2S)-1-[5-methyl-4-(3-phenylpropylamino)thieno[2,3-d]pyrimidin-6-yl]carbonylpyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[5-methyl-4-(3-phenylpropylamino)thieno[2,3-d]pyrimidin-6-yl]carbonylpyrrolidine-2-carboxamide Openeye Name: (2S)-1-[5-methyl-4-(3-phenylpropylamino)thieno[2,3-d]pyrimidine-6-carbonyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[[5-methyl-4-(3-phenylpropylamino)-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[5-methyl-4-(3-phenylpropylamino)thieno[2,3-d]pyrimidine-6-carbonyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[5-methyl-4-(3-phenylpropylamino)thieno[2,3-d]pyrimidine-6-carbonyl]pyrrolidine-2-carboxamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCCC3=CC=CC=C3)C(=O)N4CCCC4C(=O)N

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCCC3=CC=CC=C3)C(=O)N4CCC[C@H]4C(=O)N

InChI

InChI=1S/C22H25N5O2S/c1-14-17-20(24-11-5-9-15-7-3-2-4-8-15)25-13-26-21(17)30-18(14)22(29)27-12-6-10-16(27)19(23)28/h2-4,7-8,13,16H,5-6,9-12H2,1H3,(H2,23,28)(H,24,25,26)/t16-/m0/s1