5-methyl-2-phenyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 5-methyl-2-phenyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-2-phenyl-4-pyrrolidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-phenyl-4-(1-pyrrolidinyl)-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 5-methyl-2-phenyl-4-pyrrolidin-1-ylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-2-phenyl-4-pyrrolidino-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C18H16N3O2S- MolecularWeight: 338.40354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCCC3)C4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCCC3)C4=CC=CC=C4)C(=O)[O-]

InChI

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