3-[[6-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate

Systemtic Name: 3-[[6-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate Openeye Name: 3-[[6-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate CAS Name: 3-[[6-methyl-5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]amino]propanoate IUPAC Name: 3-[[6-methyl-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]propanoate Traditional Name: 3-[[6-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amino]propionate Formula: C17H16N3O2S- MolecularWeight: 326.39284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NCCC(=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NCCC(=O)[O-])C

InChI

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