2-tert-butyl-N-(4-ethylsulfonylphenyl)-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-tert-butyl-N-(4-ethylsulfonylphenyl)-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-tert-butyl-N-(4-ethylsulfonylphenyl)-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-tert-butyl-N-(4-ethylsulfonylphenyl)-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2-tert-butyl-N-(4-ethylsulfonylphenyl)-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-tert-butyl-N-(4-esylphenyl)-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(N=C(N=C3S2)C(C)(C)C)C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(N=C(N=C3S2)C(C)(C)C)C)C

InChI

InChI=1S/C21H25N3O3S2/c1-7-29(26,27)15-10-8-14(9-11-15)23-18(25)17-12(2)16-13(3)22-20(21(4,5)6)24-19(16)28-17/h8-11H,7H2,1-6H3,(H,23,25)