1-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzo[f]chromen-3-one

Systemtic Name: 1-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzo[f]chromen-3-one Openeye Name: 1-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzo[f]chromen-3-one CAS Name: 1-[[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]methyl]-3-benzo[f][1]benzopyranone IUPAC Name: 1-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]benzo[f]chromen-3-one Traditional Name: 1-[[(5-phenylthieno[2,3-d]pyrimidin-4-yl)thio]methyl]benzo[f]chromen-3-one Formula: C26H16N2O2S2 MolecularWeight: 452.54744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC4=CC(=O)OC5=C4C6=CC=CC=C6C=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC4=CC(=O)OC5=C4C6=CC=CC=C6C=C5

InChI

InChI=1S/C26H16N2O2S2/c29-22-12-18(23-19-9-5-4-8-17(19)10-11-21(23)30-22)13-31-25-24-20(16-6-2-1-3-7-16)14-32-26(24)28-15-27-25/h1-12,14-15H,13H2