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

Systemtic Name: N-[2-(pyridin-3-ylcarbonylamino)ethyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[2-(pyridine-3-carbonylamino)ethyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[2-[[oxo(3-pyridinyl)methyl]amino]ethyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[2-(pyridine-3-carbonylamino)ethyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-(2-nicotinamidoethyl)-1,3-benzothiazole-2-carboxamide Formula: C16H14N4O2S MolecularWeight: 326.37296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O2S/c21-14(11-4-3-7-17-10-11)18-8-9-19-15(22)16-20-12-5-1-2-6-13(12)23-16/h1-7,10H,8-9H2,(H,18,21)(H,19,22)