(2R)-N-aminocarbonyl-2-[5-ethyl-6-methyl-3-(3-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-3-methyl-butanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-[5-ethyl-6-methyl-3-(3-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-3-methyl-butanamide Openeye Name: (2R)-N-carbamoyl-2-[5-ethyl-6-methyl-3-(m-tolyl)-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-3-methyl-butanamide CAS Name: (2R)-N-carbamoyl-2-[[5-ethyl-6-methyl-3-(3-methylphenyl)-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]-3-methylbutanamide IUPAC Name: (2R)-N-carbamoyl-2-[5-ethyl-6-methyl-3-(3-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanyl-3-methylbutanamide Traditional Name: (2R)-N-carbamoyl-2-[[5-ethyl-4-keto-6-methyl-3-(m-tolyl)thieno[2,3-d]pyrimidin-2-yl]thio]-3-methyl-butyramide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SC(C(C)C)C(=O)NC(=O)N)C3=CC=CC(=C3)C)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)S[C@H](C(C)C)C(=O)NC(=O)N)C3=CC=CC(=C3)C)C

InChI

InChI=1S/C22H26N4O3S2/c1-6-15-13(5)30-19-16(15)20(28)26(14-9-7-8-12(4)10-14)22(25-19)31-17(11(2)3)18(27)24-21(23)29/h7-11,17H,6H2,1-5H3,(H3,23,24,27,29)/t17-/m1/s1