N-(2,5-dimethylphenyl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2,5-dimethylphenyl)-2-phenyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[(4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-2-phenylacetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-(4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: 2-[(3-allyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(2,5-dimethylphenyl)-2-phenyl-acetamide Formula: C25H23N3O2S2 MolecularWeight: 461.59902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NC4=C(C=CS4)C(=O)N3CC=C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NC4=C(C=CS4)C(=O)N3CC=C

InChI

InChI=1S/C25H23N3O2S2/c1-4-13-28-24(30)19-12-14-31-23(19)27-25(28)32-21(18-8-6-5-7-9-18)22(29)26-20-15-16(2)10-11-17(20)3/h4-12,14-15,21H,1,13H2,2-3H3,(H,26,29)