[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl] 4-phenylpiperazine-1-carbodithioate

Systemtic Name: [2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl] 4-phenylpiperazine-1-carbodithioate Openeye Name: [2-oxo-2-(2-oxochromen-3-yl)ethyl] 4-phenylpiperazine-1-carbodithioate CAS Name: 4-phenyl-1-piperazinecarbodithioic acid [2-oxo-2-(2-oxo-1-benzopyran-3-yl)ethyl] ester IUPAC Name: [2-oxo-2-(2-oxochromen-3-yl)ethyl] 4-phenylpiperazine-1-carbodithioate Traditional Name: 4-phenylpiperazine-1-carbodithioic acid [2-keto-2-(2-ketochromen-3-yl)ethyl] ester Formula: C22H20N2O3S2 MolecularWeight: 424.5358

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=S)SCC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=S)SCC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C22H20N2O3S2/c25-19(18-14-16-6-4-5-9-20(16)27-21(18)26)15-29-22(28)24-12-10-23(11-13-24)17-7-2-1-3-8-17/h1-9,14H,10-13,15H2