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

Systemtic Name: 5-(4-methylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-(2-morpholino-2-oxo-ethyl)sulfanyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methylphenyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-methylphenyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(2-keto-2-morpholino-ethyl)thio]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H23N3O3S2 MolecularWeight: 441.56632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3S2/c1-3-8-25-21(27)19-17(16-6-4-15(2)5-7-16)13-29-20(19)23-22(25)30-14-18(26)24-9-11-28-12-10-24/h3-7,13H,1,8-12,14H2,2H3