3-[2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoyl]chromen-2-one

Systemtic Name: 3-[2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoyl]chromen-2-one Openeye Name: 3-[2-(1-benzylbenzimidazol-2-yl)sulfanylacetyl]chromen-2-one CAS Name: 3-[1-oxo-2-[[1-(phenylmethyl)-2-benzimidazolyl]thio]ethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-(1-benzylbenzimidazol-2-yl)sulfanylacetyl]chromen-2-one Traditional Name: 3-[2-[(1-benzylbenzimidazol-2-yl)thio]acetyl]coumarin Formula: C25H18N2O3S MolecularWeight: 426.48702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SCC(=O)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SCC(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C25H18N2O3S/c28-22(19-14-18-10-4-7-13-23(18)30-24(19)29)16-31-25-26-20-11-5-6-12-21(20)27(25)15-17-8-2-1-3-9-17/h1-14H,15-16H2