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

Systemtic Name: N-(2,6-dimethylphenyl)-2-[(1-phenylcyclopropyl)carbonylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2,6-dimethylphenyl)-2-[(1-phenylcyclopropanecarbonyl)amino]-1,3-benzothiazole-6-carboxamide CAS Name: N-(2,6-dimethylphenyl)-2-[[oxo-(1-phenylcyclopropyl)methyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[(1-phenylcyclopropanecarbonyl)amino]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2,6-dimethylphenyl)-2-[(1-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)C4(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)C4(CC4)C5=CC=CC=C5

InChI

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