(2R)-N-aminocarbonyl-3-methyl-2-[5-(4-methylphenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-butanamide

Systemtic Name: (2R)-N-aminocarbonyl-3-methyl-2-[5-(4-methylphenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-butanamide Openeye Name: (2R)-2-[3-allyl-4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-carbamoyl-3-methyl-butanamide CAS Name: (2R)-N-carbamoyl-3-methyl-2-[[5-(4-methylphenyl)-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl]thio]butanamide IUPAC Name: (2R)-N-carbamoyl-3-methyl-2-[5-(4-methylphenyl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylbutanamide Traditional Name: (2R)-2-[[3-allyl-4-keto-5-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]thio]-N-carbamoyl-3-methyl-butyramide Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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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)C)C(=O)NC(=O)N)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)S[C@H](C(C)C)C(=O)NC(=O)N)CC=C

InChI

InChI=1S/C22H24N4O3S2/c1-5-10-26-20(28)16-15(14-8-6-13(4)7-9-14)11-30-19(16)25-22(26)31-17(12(2)3)18(27)24-21(23)29/h5-9,11-12,17H,1,10H2,2-4H3,(H3,23,24,27,29)/t17-/m1/s1