2-acetamido-N-[2-(pyridin-4-ylcarbonylamino)ethyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-acetamido-N-[2-(pyridin-4-ylcarbonylamino)ethyl]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-acetamido-N-[2-(pyridine-4-carbonylamino)ethyl]-1,3-benzothiazole-6-carboxamide CAS Name: 2-acetamido-N-[2-[[oxo(pyridin-4-yl)methyl]amino]ethyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-acetamido-N-[2-(pyridine-4-carbonylamino)ethyl]-1,3-benzothiazole-6-carboxamide Traditional Name: 2-acetamido-N-(2-isonicotinamidoethyl)-1,3-benzothiazole-6-carboxamide Formula: C18H17N5O3S MolecularWeight: 383.42428

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)NCCNC(=O)C3=CC=NC=C3

Isomeric SMILES

CC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)NCCNC(=O)C3=CC=NC=C3

InChI

InChI=1S/C18H17N5O3S/c1-11(24)22-18-23-14-3-2-13(10-15(14)27-18)17(26)21-9-8-20-16(25)12-4-6-19-7-5-12/h2-7,10H,8-9H2,1H3,(H,20,25)(H,21,26)(H,22,23,24)