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

Systemtic Name: 6-phenyl-3-(pyridin-4-ylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-phenyl-3-(4-pyridylmethyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-phenyl-3-(pyridin-4-ylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-phenyl-3-(pyridin-4-ylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-phenyl-3-(4-pyridylmethyl)-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C18H13N3OS2 MolecularWeight: 351.44532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)NC(=S)N(C3=O)CC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)NC(=S)N(C3=O)CC4=CC=NC=C4

InChI

InChI=1S/C18H13N3OS2/c22-17-14-10-15(13-4-2-1-3-5-13)24-16(14)20-18(23)21(17)11-12-6-8-19-9-7-12/h1-10H,11H2,(H,20,23)