N-(1,3-benzothiazol-2-yl)-N-butyl-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-butyl-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-butyl-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-butyl-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-butyl-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-butyl-2-(methylthio)nicotinamide Formula: C18H19N3OS2 MolecularWeight: 357.49296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NC2=CC=CC=C2S1)C(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CCCCN(C1=NC2=CC=CC=C2S1)C(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C18H19N3OS2/c1-3-4-12-21(17(22)13-8-7-11-19-16(13)23-2)18-20-14-9-5-6-10-15(14)24-18/h5-11H,3-4,12H2,1-2H3