7-oxidanyl-4-[(1-propylimidazol-2-yl)sulfanylmethyl]chromen-2-one

Systemtic Name: 7-oxidanyl-4-[(1-propylimidazol-2-yl)sulfanylmethyl]chromen-2-one Openeye Name: 7-hydroxy-4-[(1-propylimidazol-2-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-hydroxy-4-[[(1-propyl-2-imidazolyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[(1-propylimidazol-2-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-hydroxy-4-[[(1-propylimidazol-2-yl)thio]methyl]coumarin Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CCCN1C=CN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C16H16N2O3S/c1-2-6-18-7-5-17-16(18)22-10-11-8-15(20)21-14-9-12(19)3-4-13(11)14/h3-5,7-9,19H,2,6,10H2,1H3