4-(1H-benzimidazol-2-ylsulfanylmethyl)-6-ethyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-6-ethyl-7-oxidanyl-chromen-2-one Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-6-ethyl-7-hydroxy-chromen-2-one CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-6-ethyl-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-6-ethyl-7-hydroxychromen-2-one Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-6-ethyl-7-hydroxy-coumarin Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4N3)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4N3)O

InChI

InChI=1S/C19H16N2O3S/c1-2-11-7-13-12(8-18(23)24-17(13)9-16(11)22)10-25-19-20-14-5-3-4-6-15(14)21-19/h3-9,22H,2,10H2,1H3,(H,20,21)