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

Systemtic Name: 2-(butanoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(butanoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-(1-oxobutylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(butanoylamino)-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-butyramido-N-mesityl-1,3-benzothiazole-6-carboxamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)NC3=C(C=C(C=C3C)C)C

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)NC3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C21H23N3O2S/c1-5-6-18(25)23-21-22-16-8-7-15(11-17(16)27-21)20(26)24-19-13(3)9-12(2)10-14(19)4/h7-11H,5-6H2,1-4H3,(H,24,26)(H,22,23,25)