3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-methylsulfanylpyridine-3-carboxylate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)OCCCN2C3=CC=CC=C3NC2=O

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)OCCCN2C3=CC=CC=C3NC2=O

InChI

InChI=1S/C17H17N3O3S/c1-24-15-12(6-4-9-18-15)16(21)23-11-5-10-20-14-8-3-2-7-13(14)19-17(20)22/h2-4,6-9H,5,10-11H2,1H3,(H,19,22)