N-(2-chloranyl-6-methyl-phenyl)-2-[[2-(phenylmethyl)cyclopropyl]carbonylamino]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-[[2-(phenylmethyl)cyclopropyl]carbonylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-[(2-benzylcyclopropanecarbonyl)amino]-N-(2-chloro-6-methyl-phenyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[[oxo-[2-(phenylmethyl)cyclopropyl]methyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-[(2-benzylcyclopropanecarbonyl)amino]-N-(2-chloro-6-methylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-[(2-benzylcyclopropanecarbonyl)amino]-N-(2-chloro-6-methyl-phenyl)-1,3-benzothiazole-6-carboxamide Formula: C26H22ClN3O2S MolecularWeight: 475.98978

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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)C4CC4CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4CC4CC5=CC=CC=C5

InChI

InChI=1S/C26H22ClN3O2S/c1-15-6-5-9-20(27)23(15)29-24(31)17-10-11-21-22(14-17)33-26(28-21)30-25(32)19-13-18(19)12-16-7-3-2-4-8-16/h2-11,14,18-19H,12-13H2,1H3,(H,29,31)(H,28,30,32)