N-[3-(pyridin-4-ylcarbonylamino)propyl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[3-(pyridin-4-ylcarbonylamino)propyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[3-(pyridine-4-carbonylamino)propyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[3-[[oxo(pyridin-4-yl)methyl]amino]propyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[3-(pyridine-4-carbonylamino)propyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-(3-isonicotinamidopropyl)-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=CC=NC=C3

Isomeric SMILES

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

InChI

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