N-(4-bromanyl-1,3-benzothiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(4-bromanyl-1,3-benzothiazol-2-yl)-1-(5-chloranylthiophen-2-yl)sulfonyl-piperidine-2-carboxamide Openeye Name: N-(4-bromo-1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]piperidine-2-carboxamide CAS Name: N-(4-bromo-1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thiophenyl)sulfonyl]-2-piperidinecarboxamide IUPAC Name: N-(4-bromo-1,3-benzothiazol-2-yl)-1-(5-chlorothiophen-2-yl)sulfonylpiperidine-2-carboxamide Traditional Name: N-(4-bromo-1,3-benzothiazol-2-yl)-1-[(5-chloro-2-thienyl)sulfonyl]pipecolinamide Formula: C17H15BrClN3O3S3 MolecularWeight: 520.8713

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=NC3=C(S2)C=CC=C3Br)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=NC3=C(S2)C=CC=C3Br)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C17H15BrClN3O3S3/c18-10-4-3-6-12-15(10)20-17(26-12)21-16(23)11-5-1-2-9-22(11)28(24,25)14-8-7-13(19)27-14/h3-4,6-8,11H,1-2,5,9H2,(H,20,21,23)