7-ethyl-4-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one

Systemtic Name: 7-ethyl-4-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one Openeye Name: 7-ethyl-4-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-ethyl-4-[[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-ethyl-4-[[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)thio]methyl]coumarin Formula: C20H16N2O2S3 MolecularWeight: 412.54824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN(C(=S)S3)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN(C(=S)S3)C4=CC=CC=C4

InChI

InChI=1S/C20H16N2O2S3/c1-2-13-8-9-16-14(11-18(23)24-17(16)10-13)12-26-19-21-22(20(25)27-19)15-6-4-3-5-7-15/h3-11H,2,12H2,1H3