6-phenyl-3-[4-(pyridin-4-ylmethyl)phenyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-phenyl-3-[4-(pyridin-4-ylmethyl)phenyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-phenyl-3-[4-(4-pyridylmethyl)phenyl]-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-phenyl-3-[4-(pyridin-4-ylmethyl)phenyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-phenyl-3-[4-(pyridin-4-ylmethyl)phenyl]-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-phenyl-3-[4-(4-pyridylmethyl)phenyl]-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C24H17N3OS2 MolecularWeight: 427.54128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)NC(=S)N(C3=O)C4=CC=C(C=C4)CC5=CC=NC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)NC(=S)N(C3=O)C4=CC=C(C=C4)CC5=CC=NC=C5

InChI

InChI=1S/C24H17N3OS2/c28-23-20-15-21(18-4-2-1-3-5-18)30-22(20)26-24(29)27(23)19-8-6-16(7-9-19)14-17-10-12-25-13-11-17/h1-13,15H,14H2,(H,26,29)