ethyl 4-oxidanylidene-6-(pyrrolidin-1-ylcarbothioylsulfanylmethyl)chromene-2-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-6-(pyrrolidin-1-ylcarbothioylsulfanylmethyl)chromene-2-carboxylate Openeye Name: ethyl 4-oxo-6-(pyrrolidine-1-carbothioylsulfanylmethyl)chromene-2-carboxylate CAS Name: 4-oxo-6-[[[1-pyrrolidinyl(sulfanylidene)methyl]thio]methyl]-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-6-(pyrrolidine-1-carbothioylsulfanylmethyl)chromene-2-carboxylate Traditional Name: 4-keto-6-[(pyrrolidine-1-carbothioylthio)methyl]chromene-2-carboxylic acid ethyl ester Formula: C18H19NO4S2 MolecularWeight: 377.47776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=O)C2=C(O1)C=CC(=C2)CSC(=S)N3CCCC3

Isomeric SMILES

CCOC(=O)C1=CC(=O)C2=C(O1)C=CC(=C2)CSC(=S)N3CCCC3

InChI

InChI=1S/C18H19NO4S2/c1-2-22-17(21)16-10-14(20)13-9-12(5-6-15(13)23-16)11-25-18(24)19-7-3-4-8-19/h5-6,9-10H,2-4,7-8,11H2,1H3