[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 2-(2-methylphenyl)sulfanylethanoate Openeye Name: [2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl] 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl] ester IUPAC Name: [2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl] 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid [2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl] ester Formula: C23H25NO3S MolecularWeight: 395.5145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OCC(=O)C=C2C(C3=CC=CC=C3N2C)(C)C

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OCC(=O)C=C2C(C3=CC=CC=C3N2C)(C)C

InChI

InChI=1S/C23H25NO3S/c1-16-9-5-8-12-20(16)28-15-22(26)27-14-17(25)13-21-23(2,3)18-10-6-7-11-19(18)24(21)4/h5-13H,14-15H2,1-4H3