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

Systemtic Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-7-oxidanyl-chromen-2-one Openeye Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-7-hydroxy-chromen-2-one CAS Name: 4-[[(1-cyclopropyl-2-imidazolyl)thio]methyl]-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-7-hydroxychromen-2-one Traditional Name: 4-[[(1-cyclopropylimidazol-2-yl)thio]methyl]-7-hydroxy-coumarin Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=CN=C2SCC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

C1CC1N2C=CN=C2SCC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C16H14N2O3S/c19-12-3-4-13-10(7-15(20)21-14(13)8-12)9-22-16-17-5-6-18(16)11-1-2-11/h3-8,11,19H,1-2,9H2