(2S)-2-[(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]butanoic acid

Systemtic Name: (2S)-2-[(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]butanoic acid Openeye Name: (2S)-2-[(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]butanoic acid CAS Name: (2S)-2-[(2-methyl-6-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]butanoic acid IUPAC Name: (2S)-2-[(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]butanoic acid Traditional Name: (2S)-2-[(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]butyric acid Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC1=C2C=C(SC2=NC(=N1)C)C3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C(=O)O)NC1=C2C=C(SC2=NC(=N1)C)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2S/c1-3-13(17(21)22)20-15-12-9-14(11-7-5-4-6-8-11)23-16(12)19-10(2)18-15/h4-9,13H,3H2,1-2H3,(H,21,22)(H,18,19,20)/t13-/m0/s1