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

Systemtic Name: 6-methyl-3-[3-(4-methylimidazol-1-yl)propyl]-5-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-methyl-3-[3-(4-methylimidazol-1-yl)propyl]-5-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-methyl-3-[3-(4-methyl-1-imidazolyl)propyl]-5-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-methyl-3-[3-(4-methylimidazol-1-yl)propyl]-5-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-methyl-3-[3-(4-methylimidazol-1-yl)propyl]-5-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C20H20N4OS2 MolecularWeight: 396.529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)CCCN2C(=O)C3=C(NC2=S)SC(=C3C4=CC=CC=C4)C

Isomeric SMILES

CC1=CN(C=N1)CCCN2C(=O)C3=C(NC2=S)SC(=C3C4=CC=CC=C4)C

InChI

InChI=1S/C20H20N4OS2/c1-13-11-23(12-21-13)9-6-10-24-19(25)17-16(15-7-4-3-5-8-15)14(2)27-18(17)22-20(24)26/h3-5,7-8,11-12H,6,9-10H2,1-2H3,(H,22,26)