propan-2-yl 4-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzoate

Systemtic Name: propan-2-yl 4-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzoate Openeye Name: isopropyl 4-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]methyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]methyl]benzoic acid isopropyl ester Formula: C23H20N2O2S2 MolecularWeight: 420.5471

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O2S2/c1-15(2)27-23(26)18-10-8-16(9-11-18)13-28-21-19-12-20(17-6-4-3-5-7-17)29-22(19)25-14-24-21/h3-12,14-15H,13H2,1-2H3