11-[(5Z)-4-oxidanylidene-5-(2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid

Systemtic Name: 11-[(5Z)-4-oxidanylidene-5-(2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid Openeye Name: 11-[(5Z)-5-(1-allyl-2-oxo-indolin-3-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]undecanoic acid CAS Name: 11-[(5Z)-4-oxo-5-(2-oxo-1-prop-2-enyl-3-indolylidene)-2-sulfanylidene-3-thiazolidinyl]undecanoic acid IUPAC Name: 11-[(5Z)-4-oxo-5-(2-oxo-1-prop-2-enylindol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid Traditional Name: 11-[(5Z)-5-(1-allyl-2-keto-indolin-3-ylidene)-4-keto-2-thioxo-thiazolidin-3-yl]undecanoic acid Formula: C25H30N2O4S2 MolecularWeight: 486.6467

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N2O4S2/c1-2-16-26-19-14-11-10-13-18(19)21(23(26)30)22-24(31)27(25(32)33-22)17-12-8-6-4-3-5-7-9-15-20(28)29/h2,10-11,13-14H,1,3-9,12,15-17H2,(H,28,29)/b22-21-