2-[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl]thio]nicotinic acid Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC(=O)CSC3=C(C=CC=N3)C(=O)O)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=CC(=O)CSC3=C(C=CC=N3)C(=O)O)C)C

InChI

InChI=1S/C20H20N2O3S/c1-20(2)15-8-4-5-9-16(15)22(3)17(20)11-13(23)12-26-18-14(19(24)25)7-6-10-21-18/h4-11H,12H2,1-3H3,(H,24,25)