1-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-oxidanyl-3-phenyl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-oxidanyl-3-phenyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-hydroxy-3-phenyl-2-thioxo-pyrimidin-4-one CAS Name: 1-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-hydroxy-3-phenyl-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-hydroxy-3-phenyl-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-(1H-benzimidazol-2-ylmethyl)-5-ethyl-6-hydroxy-3-phenyl-2-thioxo-pyrimidin-4-one Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=S)N(C1=O)C2=CC=CC=C2)CC3=NC4=CC=CC=C4N3)O

Isomeric SMILES

CCC1=C(N(C(=S)N(C1=O)C2=CC=CC=C2)CC3=NC4=CC=CC=C4N3)O

InChI

InChI=1S/C20H18N4O2S/c1-2-14-18(25)23(12-17-21-15-10-6-7-11-16(15)22-17)20(27)24(19(14)26)13-8-4-3-5-9-13/h3-11,25H,2,12H2,1H3,(H,21,22)