N-(4-cyclohexylphenyl)-2-methyl-5-methylsulfonyl-4-oxidanylidene-1H-thieno[3,4-d]pyrimidine-7-carboxamide

Systemtic Name: N-(4-cyclohexylphenyl)-2-methyl-5-methylsulfonyl-4-oxidanylidene-1H-thieno[3,4-d]pyrimidine-7-carboxamide Openeye Name: N-(4-cyclohexylphenyl)-2-methyl-5-methylsulfonyl-4-oxo-1H-thieno[3,4-d]pyrimidine-7-carboxamide CAS Name: N-(4-cyclohexylphenyl)-2-methyl-5-methylsulfonyl-4-oxo-1H-thieno[3,4-d]pyrimidine-7-carboxamide IUPAC Name: N-(4-cyclohexylphenyl)-2-methyl-5-methylsulfonyl-4-oxo-1H-thieno[3,4-d]pyrimidine-7-carboxamide Traditional Name: N-(4-cyclohexylphenyl)-4-keto-5-mesyl-2-methyl-1H-thieno[3,4-d]pyrimidine-7-carboxamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(SC(=C2N1)C(=O)NC3=CC=C(C=C3)C4CCCCC4)S(=O)(=O)C

Isomeric SMILES

CC1=NC(=O)C2=C(SC(=C2N1)C(=O)NC3=CC=C(C=C3)C4CCCCC4)S(=O)(=O)C

InChI

InChI=1S/C21H23N3O4S2/c1-12-22-17-16(19(25)23-12)21(30(2,27)28)29-18(17)20(26)24-15-10-8-14(9-11-15)13-6-4-3-5-7-13/h8-11,13H,3-7H2,1-2H3,(H,24,26)(H,22,23,25)