1-(5-chloranylthiophen-2-yl)sulfonyl-N-(6-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)piperidine-2-carboxamide

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-N-(6-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)piperidine-2-carboxamide Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(6-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)piperidine-2-carboxamide CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(6-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)-2-piperidinecarboxamide IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-N-(6-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)piperidine-2-carboxamide Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-N-(6-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)pipecolinamide Formula: C21H24ClN3O4S3 MolecularWeight: 514.08096

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)OCC)SC1=NC(=O)C3CCCCN3S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)OCC)SC1=NC(=O)C3CCCCN3S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H24ClN3O4S3/c1-3-24-15-9-8-14(29-4-2)13-17(15)30-21(24)23-20(26)16-7-5-6-12-25(16)32(27,28)19-11-10-18(22)31-19/h8-11,13,16H,3-7,12H2,1-2H3