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

Systemtic Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-2-chloranyl-5-iodanyl-benzamide Openeye Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-2-chloro-5-iodo-benzamide CAS Name: 2-chloro-5-iodo-N-[2-(1-oxobutylamino)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-2-chloro-5-iodobenzamide Traditional Name: N-(2-butyramido-1,3-benzothiazol-6-yl)-2-chloro-5-iodo-benzamide Formula: C18H15ClIN3O2S MolecularWeight: 499.75307

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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)I)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClIN3O2S/c1-2-3-16(24)23-18-22-14-7-5-11(9-15(14)26-18)21-17(25)12-8-10(20)4-6-13(12)19/h4-9H,2-3H2,1H3,(H,21,25)(H,22,23,24)