3-[methyl-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]propanoic acid

Systemtic Name: 3-[methyl-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]propanoic acid Openeye Name: 3-[methyl-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]propanoic acid CAS Name: 3-[methyl-(6-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinyl)amino]propanoic acid IUPAC Name: 3-[methyl-(6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-yl)amino]propanoic acid Traditional Name: 3-[methyl-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amino]propionic acid Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2S1)N(C)CCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(N=CN=C2S1)N(C)CCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2S/c1-11-14(12-6-4-3-5-7-12)15-16(18-10-19-17(15)23-11)20(2)9-8-13(21)22/h3-7,10H,8-9H2,1-2H3,(H,21,22)