4-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-6-ethyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-6-ethyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-6-ethyl-7-hydroxy-chromen-2-one CAS Name: 4-[[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)thio]methyl]-6-ethyl-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-6-ethyl-7-hydroxychromen-2-one Traditional Name: 4-[[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)thio]methyl]-6-ethyl-7-hydroxy-coumarin Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NN=C(O3)C4CCCCC4)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NN=C(O3)C4CCCCC4)O

InChI

InChI=1S/C20H22N2O4S/c1-2-12-8-15-14(9-18(24)25-17(15)10-16(12)23)11-27-20-22-21-19(26-20)13-6-4-3-5-7-13/h8-10,13,23H,2-7,11H2,1H3