2-bromanyl-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 2-bromanyl-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: 2-bromo-N-[6-(1-piperidylsulfonyl)-1,3-benzothiazol-2-yl]butanamide CAS Name: 2-bromo-N-[6-(1-piperidinylsulfonyl)-1,3-benzothiazol-2-yl]butanamide IUPAC Name: 2-bromo-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: 2-bromo-N-(6-piperidinosulfonyl-1,3-benzothiazol-2-yl)butyramide Formula: C16H20BrN3O3S2 MolecularWeight: 446.3823

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCCCC3)Br

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCCCC3)Br

InChI

InChI=1S/C16H20BrN3O3S2/c1-2-12(17)15(21)19-16-18-13-7-6-11(10-14(13)24-16)25(22,23)20-8-4-3-5-9-20/h6-7,10,12H,2-5,8-9H2,1H3,(H,18,19,21)