N-(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)-4-(2-ethylbutanoylamino)benzamide

Systemtic Name: N-(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)-4-(2-ethylbutanoylamino)benzamide Openeye Name: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-4-(2-ethylbutanoylamino)benzamide CAS Name: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-4-[(2-ethyl-1-oxobutyl)amino]benzamide IUPAC Name: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-4-(2-ethylbutanoylamino)benzamide Traditional Name: 4-(2-ethylbutanoylamino)-N-(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C(=O)CC(C3)(C)C

Isomeric SMILES

CCC(CC)C(=O)NC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C(=O)CC(C3)(C)C

InChI

InChI=1S/C22H27N3O3S/c1-5-13(6-2)19(27)23-15-9-7-14(8-10-15)20(28)25-21-24-16-11-22(3,4)12-17(26)18(16)29-21/h7-10,13H,5-6,11-12H2,1-4H3,(H,23,27)(H,24,25,28)