N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-tert-butyl-benzamide

Systemtic Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-tert-butyl-benzamide Openeye Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-N-[2-(1-oxobutylamino)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-tert-butylbenzamide Traditional Name: 4-tert-butyl-N-(2-butyramido-1,3-benzothiazol-6-yl)benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H25N3O2S/c1-5-6-19(26)25-21-24-17-12-11-16(13-18(17)28-21)23-20(27)14-7-9-15(10-8-14)22(2,3)4/h7-13H,5-6H2,1-4H3,(H,23,27)(H,24,25,26)