5-azanyl-4-(3-methoxyphenyl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 5-azanyl-4-(3-methoxyphenyl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 5-amino-4-(3-methoxyphenyl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 5-amino-4-(3-methoxyphenyl)-2-phenyl-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 5-amino-4-(3-methoxyphenyl)-2-phenylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 5-amino-4-(3-methoxyphenyl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C20H15N3O3S MolecularWeight: 377.4164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C3C(=C(SC3=NC(=N2)C4=CC=CC=C4)C(=O)O)N

Isomeric SMILES

COC1=CC=CC(=C1)C2=C3C(=C(SC3=NC(=N2)C4=CC=CC=C4)C(=O)O)N

InChI

InChI=1S/C20H15N3O3S/c1-26-13-9-5-8-12(10-13)16-14-15(21)17(20(24)25)27-19(14)23-18(22-16)11-6-3-2-4-7-11/h2-10H,21H2,1H3,(H,24,25)