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

Systemtic Name: N-(2,6-dimethylphenyl)-2-[(2-phenylcyclopropyl)carbonylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2,6-dimethylphenyl)-2-[(2-phenylcyclopropanecarbonyl)amino]-1,3-benzothiazole-6-carboxamide CAS Name: N-(2,6-dimethylphenyl)-2-[[oxo-(2-phenylcyclopropyl)methyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[(2-phenylcyclopropanecarbonyl)amino]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2,6-dimethylphenyl)-2-[(2-phenylcyclopropanecarbonyl)amino]-1,3-benzothiazole-6-carboxamide Formula: C26H23N3O2S MolecularWeight: 441.54472

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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)C4CC4C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4CC4C5=CC=CC=C5

InChI

InChI=1S/C26H23N3O2S/c1-15-7-6-8-16(2)23(15)28-24(30)18-11-12-21-22(13-18)32-26(27-21)29-25(31)20-14-19(20)17-9-4-3-5-10-17/h3-13,19-20H,14H2,1-2H3,(H,28,30)(H,27,29,31)