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

Systemtic Name: phenyl 5-azanyl-4-(3-methoxyphenyl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenyl 5-amino-4-(3-methoxyphenyl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-amino-4-(3-methoxyphenyl)-2-phenyl-6-thieno[2,3-d]pyrimidinecarboxylic acid phenyl ester IUPAC Name: phenyl 5-amino-4-(3-methoxyphenyl)-2-phenylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-amino-4-(3-methoxyphenyl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylic acid phenyl ester Formula: C26H19N3O3S MolecularWeight: 453.51236

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)OC5=CC=CC=C5)N

Isomeric SMILES

COC1=CC=CC(=C1)C2=C3C(=C(SC3=NC(=N2)C4=CC=CC=C4)C(=O)OC5=CC=CC=C5)N

InChI

InChI=1S/C26H19N3O3S/c1-31-19-14-8-11-17(15-19)22-20-21(27)23(26(30)32-18-12-6-3-7-13-18)33-25(20)29-24(28-22)16-9-4-2-5-10-16/h2-15H,27H2,1H3