(2-chlorophenyl)methyl 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate

Systemtic Name: (2-chlorophenyl)methyl 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate Openeye Name: (2-chlorophenyl)methyl 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate CAS Name: 2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]propanoic acid (2-chlorophenyl)methyl ester IUPAC Name: (2-chlorophenyl)methyl 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoate Traditional Name: 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]propionic acid (2-chlorobenzyl) ester Formula: C22H17ClN2O2S2 MolecularWeight: 440.96558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1Cl)SC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)OCC1=CC=CC=C1Cl)SC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C22H17ClN2O2S2/c1-14(22(26)27-12-16-9-5-6-10-18(16)23)28-20-17-11-19(15-7-3-2-4-8-15)29-21(17)25-13-24-20/h2-11,13-14H,12H2,1H3