6-ethyl-4-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 6-ethyl-4-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[[[1-(3-methoxyphenyl)-2-imidazolyl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[[[1-(3-methoxyphenyl)imidazol-2-yl]thio]methyl]coumarin Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC=CN3C4=CC(=CC=C4)OC)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC=CN3C4=CC(=CC=C4)OC)O

InChI

InChI=1S/C22H20N2O4S/c1-3-14-9-18-15(10-21(26)28-20(18)12-19(14)25)13-29-22-23-7-8-24(22)16-5-4-6-17(11-16)27-2/h4-12,25H,3,13H2,1-2H3