5-bromanyl-N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-2-chloranyl-benzamide

Systemtic Name: 5-bromanyl-N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-2-chloranyl-benzamide Openeye Name: 5-bromo-N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-2-chloro-benzamide CAS Name: 5-bromo-2-chloro-N-[2-(1-oxobutylamino)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 5-bromo-N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-2-chlorobenzamide Traditional Name: 5-bromo-N-(2-butyramido-1,3-benzothiazol-6-yl)-2-chloro-benzamide Formula: C18H15BrClN3O2S MolecularWeight: 452.7526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrClN3O2S/c1-2-3-16(24)23-18-22-14-7-5-11(9-15(14)26-18)21-17(25)12-8-10(19)4-6-13(12)20/h4-9H,2-3H2,1H3,(H,21,25)(H,22,23,24)