3-[2,5-dimethyl-3-[(E)-(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyrrol-1-yl]benzoate

Systemtic Name: 3-[2,5-dimethyl-3-[(E)-(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyrrol-1-yl]benzoate Openeye Name: 3-[2,5-dimethyl-3-[(E)-(3-methyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]pyrrol-1-yl]benzoate CAS Name: 3-[2,5-dimethyl-3-[(E)-(3-methyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-1-pyrrolyl]benzoate IUPAC Name: 3-[2,5-dimethyl-3-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyrrol-1-yl]benzoate Traditional Name: 3-[3-[(E)-(4-keto-3-methyl-2-thioxo-thiazolidin-5-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoate Formula: C18H15N2O3S2- MolecularWeight: 371.4533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)[O-])C)C=C3C(=O)N(C(=S)S3)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)[O-])C)/C=C/3\C(=O)N(C(=S)S3)C

InChI

InChI=1S/C18H16N2O3S2/c1-10-7-13(9-15-16(21)19(3)18(24)25-15)11(2)20(10)14-6-4-5-12(8-14)17(22)23/h4-9H,1-3H3,(H,22,23)/p-1/b15-9+