N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-pyrrolidin-1-yl-pyridine-3-carboxamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-pyrrolidin-1-yl-pyridine-3-carboxamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-pyrrolidin-1-yl-pyridine-3-carboxamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-(1-pyrrolidinyl)-3-pyridinecarboxamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-2-pyrrolidin-1-ylpyridine-3-carboxamide Traditional Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-pyrrolidino-nicotinamide Formula: C18H18N4OS2 MolecularWeight: 370.49172

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(N=CC=C3)N4CCCC4

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=C(N=CC=C3)N4CCCC4

InChI

InChI=1S/C18H18N4OS2/c1-24-18-21-14-7-6-12(11-15(14)25-18)20-17(23)13-5-4-8-19-16(13)22-9-2-3-10-22/h4-8,11H,2-3,9-10H2,1H3,(H,20,23)