N-(6-bromanyl-1,3-benzothiazol-2-yl)-5-oxidanylidene-5-phenyl-pentanamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-5-oxidanylidene-5-phenyl-pentanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-5-oxo-5-phenyl-pentanamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-5-oxo-5-phenylpentanamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-5-oxo-5-phenylpentanamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-5-keto-5-phenyl-valeramide Formula: C18H15BrN2O2S MolecularWeight: 403.2929

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CCCC(=O)NC2=NC3=C(S2)C=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CCCC(=O)NC2=NC3=C(S2)C=C(C=C3)Br

InChI

InChI=1S/C18H15BrN2O2S/c19-13-9-10-14-16(11-13)24-18(20-14)21-17(23)8-4-7-15(22)12-5-2-1-3-6-12/h1-3,5-6,9-11H,4,7-8H2,(H,20,21,23)