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

Systemtic Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-7-methoxy-chromen-2-one Openeye Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-7-methoxy-chromen-2-one CAS Name: 4-[[(1-cyclopropyl-2-imidazolyl)thio]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-7-methoxychromen-2-one Traditional Name: 4-[[(1-cyclopropylimidazol-2-yl)thio]methyl]-7-methoxy-coumarin Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC=CN3C4CC4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC=CN3C4CC4

InChI

InChI=1S/C17H16N2O3S/c1-21-13-4-5-14-11(8-16(20)22-15(14)9-13)10-23-17-18-6-7-19(17)12-2-3-12/h4-9,12H,2-3,10H2,1H3