methyl 4-[4-(5-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)butanoylamino]benzoate

Systemtic Name: methyl 4-[4-(5-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl)butanoylamino]benzoate Openeye Name: methyl 4-[4-(5-methyl-4-oxo-2-thioxo-thiazolidin-3-yl)butanoylamino]benzoate CAS Name: 4-[[4-(5-methyl-4-oxo-2-sulfanylidene-3-thiazolidinyl)-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(5-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)butanoylamino]benzoate Traditional Name: 4-[4-(4-keto-5-methyl-2-thioxo-thiazolidin-3-yl)butanoylamino]benzoic acid methyl ester Formula: C16H18N2O4S2 MolecularWeight: 366.45512

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(=S)S1)CCCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1C(=O)N(C(=S)S1)CCCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C16H18N2O4S2/c1-10-14(20)18(16(23)24-10)9-3-4-13(19)17-12-7-5-11(6-8-12)15(21)22-2/h5-8,10H,3-4,9H2,1-2H3,(H,17,19)