1-(4-iodophenyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-(4-iodophenyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-(4-iodophenyl)-5-(pyrimidin-5-ylmethyl)-2-thioxo-pyrimidin-4-one CAS Name: 1-(4-iodophenyl)-5-(5-pyrimidinylmethyl)-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-(4-iodophenyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-(4-iodophenyl)-5-(5-pyrimidylmethyl)-2-thioxo-pyrimidin-4-one Formula: C15H11IN4OS MolecularWeight: 422.24351

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=C(C(=O)NC2=S)CC3=CN=CN=C3)I

Isomeric SMILES

C1=CC(=CC=C1N2C=C(C(=O)NC2=S)CC3=CN=CN=C3)I

InChI

InChI=1S/C15H11IN4OS/c16-12-1-3-13(4-2-12)20-8-11(14(21)19-15(20)22)5-10-6-17-9-18-7-10/h1-4,6-9H,5H2,(H,19,21,22)