dimethyl 5-azanyl-3-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C21H17N3O5S2 MolecularWeight: 455.50678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC2=C3C(=CSC3=NC=N2)C4=CC=CC=C4)C(=O)OC)N

InChI

InChI=1S/C21H17N3O5S2/c1-27-20(25)14-12(16(21(26)28-2)31-17(14)22)8-29-18-15-13(11-6-4-3-5-7-11)9-30-19(15)24-10-23-18/h3-7,9-10H,8,22H2,1-2H3