N-(2-chloranyl-6-methyl-phenyl)-2-(2-pyridin-2-ylethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-(2-pyridin-2-ylethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-[2-(2-pyridyl)ethylcarbamoylamino]-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[[oxo-[2-(2-pyridinyl)ethylamino]methyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-(2-pyridin-2-ylethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-[2-(2-pyridyl)ethylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Formula: C23H20ClN5O2S MolecularWeight: 465.9552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NCCC4=CC=CC=N4

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NCCC4=CC=CC=N4

InChI

InChI=1S/C23H20ClN5O2S/c1-14-5-4-7-17(24)20(14)28-21(30)15-8-9-18-19(13-15)32-23(27-18)29-22(31)26-12-10-16-6-2-3-11-25-16/h2-9,11,13H,10,12H2,1H3,(H,28,30)(H2,26,27,29,31)