(2R)-4-azanyl-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-azanyl-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-4-oxidanylidene-butanoate Openeye Name: (2R)-4-amino-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-4-oxo-butanoate CAS Name: (2R)-4-amino-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)amino]-4-oxobutanoate IUPAC Name: (2R)-4-amino-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-4-oxobutanoate Traditional Name: (2R)-4-amino-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-4-keto-butyrate Formula: C12H13N4O3S- MolecularWeight: 293.32162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC(CC(=O)N)C(=O)[O-])C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N[C@H](CC(=O)N)C(=O)[O-])C

InChI

InChI=1S/C12H14N4O3S/c1-5-6(2)20-11-9(5)10(14-4-15-11)16-7(12(18)19)3-8(13)17/h4,7H,3H2,1-2H3,(H2,13,17)(H,18,19)(H,14,15,16)/p-1/t7-/m1/s1