[1-(3-bromanyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)-1-oxidanylidene-propan-2-yl] N,N-diethylcarbamodithioate

Systemtic Name: [1-(3-bromanyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)-1-oxidanylidene-propan-2-yl] N,N-diethylcarbamodithioate Openeye Name: [2-(3-bromo-7-hydroxy-4-methyl-2-oxo-chromen-8-yl)-1-methyl-2-oxo-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [1-(3-bromo-7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-bromo-7-hydroxy-4-methyl-2-oxochromen-8-yl)-1-oxopropan-2-yl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2-(3-bromo-7-hydroxy-2-keto-4-methyl-chromen-8-yl)-2-keto-1-methyl-ethyl] ester Formula: C18H20BrNO4S2 MolecularWeight: 458.3897

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC(C)C(=O)C1=C(C=CC2=C1OC(=O)C(=C2C)Br)O

Isomeric SMILES

CCN(CC)C(=S)SC(C)C(=O)C1=C(C=CC2=C1OC(=O)C(=C2C)Br)O

InChI

InChI=1S/C18H20BrNO4S2/c1-5-20(6-2)18(25)26-10(4)15(22)13-12(21)8-7-11-9(3)14(19)17(23)24-16(11)13/h7-8,10,21H,5-6H2,1-4H3