(2S)-1-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-(2-methyl-6-phenyl-4-thieno[2,3-d]pyrimidinyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)proline Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C=C(SC2=N1)C3=CC=CC=C3)N4CCCC4C(=O)O

Isomeric SMILES

CC1=NC(=C2C=C(SC2=N1)C3=CC=CC=C3)N4CCC[C@H]4C(=O)O

InChI

InChI=1S/C18H17N3O2S/c1-11-19-16(21-9-5-8-14(21)18(22)23)13-10-15(24-17(13)20-11)12-6-3-2-4-7-12/h2-4,6-7,10,14H,5,8-9H2,1H3,(H,22,23)/t14-/m0/s1