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

Systemtic Name: 5-methyl-4-(4-methylpiperidin-1-yl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-4-(4-methyl-1-piperidyl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-(4-methyl-1-piperidinyl)-2-phenyl-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 5-methyl-4-(4-methylpiperidin-1-yl)-2-phenylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-(4-methylpiperidino)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C20H20N3O2S- MolecularWeight: 366.4567

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C3C(=C(SC3=NC(=N2)C4=CC=CC=C4)C(=O)[O-])C

Isomeric SMILES

CC1CCN(CC1)C2=C3C(=C(SC3=NC(=N2)C4=CC=CC=C4)C(=O)[O-])C

InChI

InChI=1S/C20H21N3O2S/c1-12-8-10-23(11-9-12)18-15-13(2)16(20(24)25)26-19(15)22-17(21-18)14-6-4-3-5-7-14/h3-7,12H,8-11H2,1-2H3,(H,24,25)/p-1