methyl (2R)-4-methyl-2-[2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]pentanoate

Systemtic Name: methyl (2R)-4-methyl-2-[2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]pentanoate Openeye Name: methyl (2R)-4-methyl-2-[[2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]pentanoate CAS Name: (2R)-4-methyl-2-[[1-oxo-2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)ethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2R)-4-methyl-2-[[2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetyl]amino]pentanoate Traditional Name: (2R)-2-[[2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)NC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O4S/c1-13(2)9-16(21(27)28-3)23-17(25)10-24-12-22-19-18(20(24)26)15(11-29-19)14-7-5-4-6-8-14/h4-8,11-13,16H,9-10H2,1-3H3,(H,23,25)/t16-/m1/s1