N-benzo[g][1,3]benzothiazol-2-yl-1-(5-chloranylthiophen-2-yl)sulfonyl-piperidine-2-carboxamide

Systemtic Name: N-benzo[g][1,3]benzothiazol-2-yl-1-(5-chloranylthiophen-2-yl)sulfonyl-piperidine-2-carboxamide Openeye Name: N-benzo[g][1,3]benzothiazol-2-yl-1-[(5-chloro-2-thienyl)sulfonyl]piperidine-2-carboxamide CAS Name: N-(2-benzo[g][1,3]benzothiazolyl)-1-[(5-chloro-2-thiophenyl)sulfonyl]-2-piperidinecarboxamide IUPAC Name: N-benzo[g][1,3]benzothiazol-2-yl-1-(5-chlorothiophen-2-yl)sulfonylpiperidine-2-carboxamide Traditional Name: N-benzo[g][1,3]benzothiazol-2-yl-1-[(5-chloro-2-thienyl)sulfonyl]pipecolinamide Formula: C21H18ClN3O3S3 MolecularWeight: 492.03392

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=NC3=C(S2)C4=CC=CC=C4C=C3)S(=O)(=O)C5=CC=C(S5)Cl

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=NC3=C(S2)C4=CC=CC=C4C=C3)S(=O)(=O)C5=CC=C(S5)Cl

InChI

InChI=1S/C21H18ClN3O3S3/c22-17-10-11-18(29-17)31(27,28)25-12-4-3-7-16(25)20(26)24-21-23-15-9-8-13-5-1-2-6-14(13)19(15)30-21/h1-2,5-6,8-11,16H,3-4,7,12H2,(H,23,24,26)