2-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)-N-(4-piperazin-1-ylpyridin-3-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)-N-(4-piperazin-1-ylpyridin-3-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-(3-ethyl-2-oxo-benzimidazol-1-yl)-N-(4-piperazin-1-yl-3-pyridyl)thiazole-4-carboxamide CAS Name: 2-(3-ethyl-2-oxo-1-benzimidazolyl)-N-[4-(1-piperazinyl)-3-pyridinyl]-4-thiazolecarboxamide IUPAC Name: 2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-(4-piperazin-1-ylpyridin-3-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-(3-ethyl-2-keto-benzimidazol-1-yl)-N-(4-piperazino-3-pyridyl)thiazole-4-carboxamide Formula: C22H23N7O2S MolecularWeight: 449.52872

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)C3=NC(=CS3)C(=O)NC4=C(C=CN=C4)N5CCNCC5

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)C3=NC(=CS3)C(=O)NC4=C(C=CN=C4)N5CCNCC5

InChI

InChI=1S/C22H23N7O2S/c1-2-28-18-5-3-4-6-19(18)29(22(28)31)21-26-16(14-32-21)20(30)25-15-13-24-8-7-17(15)27-11-9-23-10-12-27/h3-8,13-14,23H,2,9-12H2,1H3,(H,25,30)