(2S,3R)-2-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]-3-methyl-pentanoate

Systemtic Name: (2S,3R)-2-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]-3-methyl-pentanoate Openeye Name: (2S,3R)-2-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]-3-methyl-pentanoate CAS Name: (2S,3R)-2-[(6-ethyl-2-methyl-4-thieno[2,3-d]pyrimidinyl)amino]-3-methylpentanoate IUPAC Name: (2S,3R)-2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]-3-methylpentanoate Traditional Name: (2S,3R)-2-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]-3-methyl-valerate Formula: C15H20N3O2S- MolecularWeight: 306.4032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)C)NC(C(C)CC)C(=O)[O-]

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)C)N[C@@H]([C@H](C)CC)C(=O)[O-]

InChI

InChI=1S/C15H21N3O2S/c1-5-8(3)12(15(19)20)18-13-11-7-10(6-2)21-14(11)17-9(4)16-13/h7-8,12H,5-6H2,1-4H3,(H,19,20)(H,16,17,18)/p-1/t8-,12+/m1/s1