2-[(5E)-5-[1-(3-methylbutyl)-2-oxidanylidene-indol-3-ylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid

Systemtic Name: 2-[(5E)-5-[1-(3-methylbutyl)-2-oxidanylidene-indol-3-ylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoic acid Openeye Name: 2-[(5E)-5-(1-isopentyl-2-oxo-indolin-3-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]acetic acid CAS Name: 2-[(5E)-5-[1-(3-methylbutyl)-2-oxo-3-indolylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid IUPAC Name: 2-[(5E)-5-[1-(3-methylbutyl)-2-oxoindol-3-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid Traditional Name: 2-[(5E)-5-(1-isoamyl-2-keto-indolin-3-ylidene)-4-keto-2-thioxo-thiazolidin-3-yl]acetic acid Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2C(=C3C(=O)N(C(=S)S3)CC(=O)O)C1=O

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2/C(=C\3/C(=O)N(C(=S)S3)CC(=O)O)/C1=O

InChI

InChI=1S/C18H18N2O4S2/c1-10(2)7-8-19-12-6-4-3-5-11(12)14(16(19)23)15-17(24)20(9-13(21)22)18(25)26-15/h3-6,10H,7-9H2,1-2H3,(H,21,22)/b15-14+