5-methyl-N-[(3-methylphenyl)methyl]-4-(pyridin-2-ylmethylamino)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 5-methyl-N-[(3-methylphenyl)methyl]-4-(pyridin-2-ylmethylamino)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 5-methyl-N-(m-tolylmethyl)-4-(2-pyridylmethylamino)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 5-methyl-N-[(3-methylphenyl)methyl]-4-(2-pyridinylmethylamino)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 5-methyl-N-[(3-methylphenyl)methyl]-4-(pyridin-2-ylmethylamino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 5-methyl-N-(3-methylbenzyl)-4-(2-pyridylmethylamino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2=C(C3=C(N=CN=C3S2)NCC4=CC=CC=N4)C

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2=C(C3=C(N=CN=C3S2)NCC4=CC=CC=N4)C

InChI

InChI=1S/C22H21N5OS/c1-14-6-5-7-16(10-14)11-25-21(28)19-15(2)18-20(26-13-27-22(18)29-19)24-12-17-8-3-4-9-23-17/h3-10,13H,11-12H2,1-2H3,(H,25,28)(H,24,26,27)