(2S)-3-methyl-2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]butanoate

Systemtic Name: (2S)-3-methyl-2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]butanoate Openeye Name: (2S)-3-methyl-2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]butanoate IUPAC Name: (2S)-3-methyl-2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]butyrate Formula: C17H16N3O2S- MolecularWeight: 326.39284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC1=C2C(=CSC2=NC=N1)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC1=C2C(=CSC2=NC=N1)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2S/c1-10(2)14(17(21)22)20-15-13-12(11-6-4-3-5-7-11)8-23-16(13)19-9-18-15/h3-10,14H,1-2H3,(H,21,22)(H,18,19,20)/p-1/t14-/m0/s1