N,2,5-trimethyl-4-[methyl-(4-propan-2-ylphenyl)amino]-N-(phenylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N,2,5-trimethyl-4-[methyl-(4-propan-2-ylphenyl)amino]-N-(phenylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-benzyl-4-(4-isopropyl-N-methyl-anilino)-N,2,5-trimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N,2,5-trimethyl-4-(N-methyl-4-propan-2-ylanilino)-N-(phenylmethyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-benzyl-N,2,5-trimethyl-4-(N-methyl-4-propan-2-ylanilino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-benzyl-4-(4-isopropyl-N-methyl-anilino)-N,2,5-trimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C27H30N4OS MolecularWeight: 458.6183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N(C)C3=CC=C(C=C3)C(C)C)C)C(=O)N(C)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N(C)C3=CC=C(C=C3)C(C)C)C)C(=O)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C27H30N4OS/c1-17(2)21-12-14-22(15-13-21)31(6)25-23-18(3)24(33-26(23)29-19(4)28-25)27(32)30(5)16-20-10-8-7-9-11-20/h7-15,17H,16H2,1-6H3