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

Systemtic Name: 3-(3-imidazol-1-ylpropyl)-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(3-imidazol-1-ylpropyl)-6-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[3-(1-imidazolyl)propyl]-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 3-(3-imidazol-1-ylpropyl)-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3-imidazol-1-ylpropyl)-6-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C18H16N4OS2 MolecularWeight: 368.47584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)NC(=S)N(C3=O)CCCN4C=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)NC(=S)N(C3=O)CCCN4C=CN=C4

InChI

InChI=1S/C18H16N4OS2/c23-17-14-11-15(13-5-2-1-3-6-13)25-16(14)20-18(24)22(17)9-4-8-21-10-7-19-12-21/h1-3,5-7,10-12H,4,8-9H2,(H,20,24)