3-(3-imidazol-1-ylpropyl)-6-methyl-5-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(3-imidazol-1-ylpropyl)-6-methyl-5-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(3-imidazol-1-ylpropyl)-6-methyl-5-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[3-(1-imidazolyl)propyl]-6-methyl-5-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 3-(3-imidazol-1-ylpropyl)-6-methyl-5-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3-imidazol-1-ylpropyl)-6-methyl-5-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C19H18N4OS2 MolecularWeight: 382.50242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)NC(=S)N(C2=O)CCCN3C=CN=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(S1)NC(=S)N(C2=O)CCCN3C=CN=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H18N4OS2/c1-13-15(14-6-3-2-4-7-14)16-17(26-13)21-19(25)23(18(16)24)10-5-9-22-11-8-20-12-22/h2-4,6-8,11-12H,5,9-10H2,1H3,(H,21,25)