N-(3-methylphenyl)-2-[(3E)-3-(3-octyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxidanylidene-indol-1-yl]ethanamide

Systemtic Name: N-(3-methylphenyl)-2-[(3E)-3-(3-octyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxidanylidene-indol-1-yl]ethanamide Openeye Name: N-(m-tolyl)-2-[(3E)-3-(3-octyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)-2-oxo-indolin-1-yl]acetamide CAS Name: N-(3-methylphenyl)-2-[(3E)-3-(3-octyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-2-oxo-1-indolyl]acetamide IUPAC Name: N-(3-methylphenyl)-2-[(3E)-3-(3-octyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxoindol-1-yl]acetamide Traditional Name: 2-[(3E)-2-keto-3-(4-keto-3-octyl-2-thioxo-thiazolidin-5-ylidene)indolin-1-yl]-N-(m-tolyl)acetamide Formula: C28H31N3O3S2 MolecularWeight: 521.69404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=CC(=C4)C)SC1=S

Isomeric SMILES

CCCCCCCCN1C(=O)/C(=C\2/C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=CC(=C4)C)/SC1=S

InChI

InChI=1S/C28H31N3O3S2/c1-3-4-5-6-7-10-16-30-27(34)25(36-28(30)35)24-21-14-8-9-15-22(21)31(26(24)33)18-23(32)29-20-13-11-12-19(2)17-20/h8-9,11-15,17H,3-7,10,16,18H2,1-2H3,(H,29,32)/b25-24+