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

Systemtic Name: 4-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-6-ethyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[(1-cyclohexyltetrazol-5-yl)sulfanylmethyl]-6-ethyl-7-hydroxy-chromen-2-one CAS Name: 4-[[(1-cyclohexyl-5-tetrazolyl)thio]methyl]-6-ethyl-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[(1-cyclohexyltetrazol-5-yl)sulfanylmethyl]-6-ethyl-7-hydroxychromen-2-one Traditional Name: 4-[[(1-cyclohexyltetrazol-5-yl)thio]methyl]-6-ethyl-7-hydroxy-coumarin Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NN=NN3C4CCCCC4)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NN=NN3C4CCCCC4)O

InChI

InChI=1S/C19H22N4O3S/c1-2-12-8-15-13(9-18(25)26-17(15)10-16(12)24)11-27-19-20-21-22-23(19)14-6-4-3-5-7-14/h8-10,14,24H,2-7,11H2,1H3