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

Systemtic Name: N-(2,6-dimethylphenyl)-2-[[2-(phenylmethyl)cyclopropyl]carbonylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-[(2-benzylcyclopropanecarbonyl)amino]-N-(2,6-dimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-(2,6-dimethylphenyl)-2-[[oxo-[2-(phenylmethyl)cyclopropyl]methyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-[(2-benzylcyclopropanecarbonyl)amino]-N-(2,6-dimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-[(2-benzylcyclopropanecarbonyl)amino]-N-(2,6-dimethylphenyl)-1,3-benzothiazole-6-carboxamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25N3O2S/c1-16-7-6-8-17(2)24(16)29-25(31)19-11-12-22-23(15-19)33-27(28-22)30-26(32)21-14-20(21)13-18-9-4-3-5-10-18/h3-12,15,20-21H,13-14H2,1-2H3,(H,29,31)(H,28,30,32)