2-(5,6-dimethyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-ethanoylphenyl)propanamide

Systemtic Name: 2-(5,6-dimethyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-ethanoylphenyl)propanamide Openeye Name: N-(4-acetylphenyl)-2-(5,6-dimethyl-4-oxo-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide CAS Name: N-(4-acetylphenyl)-2-[(5,6-dimethyl-4-oxo-3-phenethyl-2-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: N-(4-acetylphenyl)-2-(5,6-dimethyl-4-oxo-3-phenethylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-(4-acetylphenyl)-2-[(4-keto-5,6-dimethyl-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)thio]propionamide Formula: C27H27N3O3S2 MolecularWeight: 505.65158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SC(C)C(=O)NC3=CC=C(C=C3)C(=O)C)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SC(C)C(=O)NC3=CC=C(C=C3)C(=O)C)CCC4=CC=CC=C4)C

InChI

InChI=1S/C27H27N3O3S2/c1-16-18(3)34-25-23(16)26(33)30(15-14-20-8-6-5-7-9-20)27(29-25)35-19(4)24(32)28-22-12-10-21(11-13-22)17(2)31/h5-13,19H,14-15H2,1-4H3,(H,28,32)