4-(5,6-dimethyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)butanamide

Systemtic Name: 4-(5,6-dimethyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)butanamide Openeye Name: 4-(5,6-dimethyl-4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)butanamide CAS Name: 4-[(5,6-dimethyl-4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-(2,6-dimethylphenyl)butanamide IUPAC Name: 4-(5,6-dimethyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)butanamide Traditional Name: N-(2,6-dimethylphenyl)-4-[(4-keto-5,6-dimethyl-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]butyramide Formula: C26H27N3O2S2 MolecularWeight: 477.64148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSC2=NC3=C(C(=C(S3)C)C)C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSC2=NC3=C(C(=C(S3)C)C)C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O2S2/c1-16-10-8-11-17(2)23(16)27-21(30)14-9-15-32-26-28-24-22(18(3)19(4)33-24)25(31)29(26)20-12-6-5-7-13-20/h5-8,10-13H,9,14-15H2,1-4H3,(H,27,30)