N-(2,6-dimethylphenyl)-2-(2-phenylpropanoylamino)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-(2-phenylpropanoylamino)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2,6-dimethylphenyl)-2-(2-phenylpropanoylamino)-1,3-benzothiazole-6-carboxamide CAS Name: N-(2,6-dimethylphenyl)-2-[(1-oxo-2-phenylpropyl)amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2,6-dimethylphenyl)-2-(2-phenylpropanoylamino)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2,6-dimethylphenyl)-2-(hydratropoylamino)-1,3-benzothiazole-6-carboxamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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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)C(C)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O2S/c1-15-8-7-9-16(2)22(15)27-24(30)19-12-13-20-21(14-19)31-25(26-20)28-23(29)17(3)18-10-5-4-6-11-18/h4-14,17H,1-3H3,(H,27,30)(H,26,28,29)