N-(5-chloranyl-1,3-benzothiazol-2-yl)-1-(2-cyanophenyl)sulfonyl-N-ethyl-piperidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-1,3-benzothiazol-2-yl)-1-(2-cyanophenyl)sulfonyl-N-ethyl-piperidine-4-carboxamide Openeye Name: N-(5-chloro-1,3-benzothiazol-2-yl)-1-(2-cyanophenyl)sulfonyl-N-ethyl-piperidine-4-carboxamide CAS Name: N-(5-chloro-1,3-benzothiazol-2-yl)-1-(2-cyanophenyl)sulfonyl-N-ethyl-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-1,3-benzothiazol-2-yl)-1-(2-cyanophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide Traditional Name: N-(5-chloro-1,3-benzothiazol-2-yl)-1-(2-cyanophenyl)sulfonyl-N-ethyl-isonipecotamide Formula: C22H21ClN4O3S2 MolecularWeight: 489.01014

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=C(S1)C=CC(=C2)Cl)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

CCN(C1=NC2=C(S1)C=CC(=C2)Cl)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C22H21ClN4O3S2/c1-2-27(22-25-18-13-17(23)7-8-19(18)31-22)21(28)15-9-11-26(12-10-15)32(29,30)20-6-4-3-5-16(20)14-24/h3-8,13,15H,2,9-12H2,1H3