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

Systemtic Name: 2-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]-3-phenyl-propanoic acid Openeye Name: 2-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]-3-phenyl-propanoic acid CAS Name: 2-[(6-ethyl-2-methyl-4-thieno[2,3-d]pyrimidinyl)amino]-3-phenylpropanoic acid IUPAC Name: 2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]-3-phenylpropanoic acid Traditional Name: 2-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]-3-phenyl-propionic acid Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)C)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)C)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H19N3O2S/c1-3-13-10-14-16(19-11(2)20-17(14)24-13)21-15(18(22)23)9-12-7-5-4-6-8-12/h4-8,10,15H,3,9H2,1-2H3,(H,22,23)(H,19,20,21)