N-[3-(pyridin-3-ylcarbonylamino)propyl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[3-(pyridin-3-ylcarbonylamino)propyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[3-(pyridine-3-carbonylamino)propyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[3-[[oxo(3-pyridinyl)methyl]amino]propyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[3-(pyridine-3-carbonylamino)propyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-(3-nicotinamidopropyl)-1,3-benzothiazole-2-carboxamide Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=O)NCCCNC(=O)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(=O)NCCCNC(=O)C3=CN=CC=C3

InChI

InChI=1S/C17H16N4O2S/c22-15(12-5-3-8-18-11-12)19-9-4-10-20-16(23)17-21-13-6-1-2-7-14(13)24-17/h1-3,5-8,11H,4,9-10H2,(H,19,22)(H,20,23)