(5E)-2-methyl-5-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-pyrrol-1-yl-heptanoic acid

Systemtic Name: (5E)-2-methyl-5-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-pyrrol-1-yl-heptanoic acid Openeye Name: (5E)-2-methyl-5-(4-oxo-2-thioxo-thiazolidin-5-ylidene)-2-pyrrol-1-yl-heptanoic acid CAS Name: (5E)-2-methyl-5-(4-oxo-2-sulfanylidene-5-thiazolidinylidene)-2-(1-pyrrolyl)heptanoic acid IUPAC Name: (5E)-2-methyl-5-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-pyrrol-1-ylheptanoic acid Traditional Name: (5E)-5-(4-keto-2-thioxo-thiazolidin-5-ylidene)-2-methyl-2-pyrrol-1-yl-enanthic acid Formula: C15H18N2O3S2 MolecularWeight: 338.44502

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)NC(=S)S1)CCC(C)(C(=O)O)N2C=CC=C2

Isomeric SMILES

CC/C(=C\1/C(=O)NC(=S)S1)/CCC(C)(C(=O)O)N2C=CC=C2

InChI

InChI=1S/C15H18N2O3S2/c1-3-10(11-12(18)16-14(21)22-11)6-7-15(2,13(19)20)17-8-4-5-9-17/h4-5,8-9H,3,6-7H2,1-2H3,(H,19,20)(H,16,18,21)/b11-10+