5-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione

Systemtic Name: 5-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione Openeye Name: 5-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-3-prop-2-ynyl-thiazolidine-2,4-dione CAS Name: 5-[[1-(4-butylphenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-3-prop-2-ynylthiazolidine-2,4-dione IUPAC Name: 5-[[1-(4-butylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione Traditional Name: 5-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-3-propargyl-thiazolidine-2,4-quinone Formula: C23H24N2O2S MolecularWeight: 392.51386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)N(C(=O)S3)CC#C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)N(C(=O)S3)CC#C)C

InChI

InChI=1S/C23H24N2O2S/c1-5-7-8-18-9-11-20(12-10-18)25-16(3)14-19(17(25)4)15-21-22(26)24(13-6-2)23(27)28-21/h2,9-12,14-15H,5,7-8,13H2,1,3-4H3