5-(4-methylphenyl)-2-[1-oxidanylidene-1-(2-oxidanylideneimidazolidin-1-yl)propan-2-yl]sulfanyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-methylphenyl)-2-[1-oxidanylidene-1-(2-oxidanylideneimidazolidin-1-yl)propan-2-yl]sulfanyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[1-methyl-2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methylphenyl)-2-[[1-oxo-1-(2-oxo-1-imidazolidinyl)propan-2-yl]thio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-methylphenyl)-2-[1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl]sulfanyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[[2-keto-2-(2-ketoimidazolidin-1-yl)-1-methyl-ethyl]thio]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H22N4O3S2 MolecularWeight: 454.56508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SC(C)C(=O)N4CCNC4=O)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SC(C)C(=O)N4CCNC4=O)CC=C

InChI

InChI=1S/C22H22N4O3S2/c1-4-10-26-20(28)17-16(15-7-5-13(2)6-8-15)12-30-18(17)24-22(26)31-14(3)19(27)25-11-9-23-21(25)29/h4-8,12,14H,1,9-11H2,2-3H3,(H,23,29)