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

Systemtic Name: 3-[2,5-dimethyl-3-[(Z)-(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyrrol-1-yl]benzoate Openeye Name: 3-[3-[(Z)-(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoate CAS Name: 3-[2,5-dimethyl-3-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-5-thiazolidinylidene)methyl]-1-pyrrolyl]benzoate IUPAC Name: 3-[2,5-dimethyl-3-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]pyrrol-1-yl]benzoate Traditional Name: 3-[3-[(Z)-(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoate Formula: C20H17N2O3S2- MolecularWeight: 397.49058

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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)CC=C

Isomeric SMILES

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

InChI

InChI=1S/C20H18N2O3S2/c1-4-8-21-18(23)17(27-20(21)26)11-15-9-12(2)22(13(15)3)16-7-5-6-14(10-16)19(24)25/h4-7,9-11H,1,8H2,2-3H3,(H,24,25)/p-1/b17-11-