2-(2-cyclohexylethanoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-(2-cyclohexylethanoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-[(2-cyclohexylacetyl)amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-[(2-cyclohexyl-1-oxoethyl)amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-[(2-cyclohexylacetyl)amino]-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-[(2-cyclohexylacetyl)amino]-N-mesityl-1,3-benzothiazole-6-carboxamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)CC4CCCCC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)CC4CCCCC4)C

InChI

InChI=1S/C25H29N3O2S/c1-15-11-16(2)23(17(3)12-15)28-24(30)19-9-10-20-21(14-19)31-25(26-20)27-22(29)13-18-7-5-4-6-8-18/h9-12,14,18H,4-8,13H2,1-3H3,(H,28,30)(H,26,27,29)