4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-7-ethyl-chromen-2-one

Systemtic Name: 4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-7-ethyl-chromen-2-one Openeye Name: 4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-7-ethyl-chromen-2-one CAS Name: 4-[(4,5-dihydro-1H-imidazol-2-ylthio)methyl]-7-ethyl-1-benzopyran-2-one IUPAC Name: 4-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-7-ethylchromen-2-one Traditional Name: 7-ethyl-4-[(2-imidazolin-2-ylthio)methyl]coumarin Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NCCN3

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NCCN3

InChI

InChI=1S/C15H16N2O2S/c1-2-10-3-4-12-11(8-14(18)19-13(12)7-10)9-20-15-16-5-6-17-15/h3-4,7-8H,2,5-6,9H2,1H3,(H,16,17)