(phenylmethyl) 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoate

Systemtic Name: (phenylmethyl) 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoate Openeye Name: benzyl 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetate CAS Name: 2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetate Traditional Name: 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]acetic acid benzyl ester Formula: C21H16N2O2S2 MolecularWeight: 392.49394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CSC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CSC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O2S2/c24-19(25-12-15-7-3-1-4-8-15)13-26-20-17-11-18(16-9-5-2-6-10-16)27-21(17)23-14-22-20/h1-11,14H,12-13H2