5-(3,4-dimethylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3,4-dimethylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-5-(3,4-dimethylphenyl)-2-(2-morpholino-2-oxo-ethyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3,4-dimethylphenyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(3,4-dimethylphenyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-5-(3,4-dimethylphenyl)-2-[(2-keto-2-morpholino-ethyl)thio]thieno[2,3-d]pyrimidin-4-one Formula: C23H25N3O3S2 MolecularWeight: 455.5929

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)N4CCOCC4)CC=C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)N4CCOCC4)CC=C)C

InChI

InChI=1S/C23H25N3O3S2/c1-4-7-26-22(28)20-18(17-6-5-15(2)16(3)12-17)13-30-21(20)24-23(26)31-14-19(27)25-8-10-29-11-9-25/h4-6,12-13H,1,7-11,14H2,2-3H3