6-ethanoyl-5-methyl-2-[(1-prop-2-enylbenzimidazol-2-yl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-ethanoyl-5-methyl-2-[(1-prop-2-enylbenzimidazol-2-yl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-acetyl-2-[(1-allylbenzimidazol-2-yl)sulfanylmethyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-acetyl-5-methyl-2-[[(1-prop-2-enyl-2-benzimidazolyl)thio]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-acetyl-5-methyl-2-[(1-prop-2-enylbenzimidazol-2-yl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-acetyl-2-[[(1-allylbenzimidazol-2-yl)thio]methyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H18N4O2S2 MolecularWeight: 410.51252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC4=CC=CC=C4N3CC=C)C(=O)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC4=CC=CC=C4N3CC=C)C(=O)C

InChI

InChI=1S/C20H18N4O2S2/c1-4-9-24-14-8-6-5-7-13(14)21-20(24)27-10-15-22-18(26)16-11(2)17(12(3)25)28-19(16)23-15/h4-8H,1,9-10H2,2-3H3,(H,22,23,26)