N-(1,3-benzothiazol-2-yl)-1-(4-chlorophenyl)sulfonyl-N-ethyl-piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-(4-chlorophenyl)sulfonyl-N-ethyl-piperidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-(4-chlorophenyl)sulfonyl-N-ethyl-piperidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-(4-chlorophenyl)sulfonyl-N-ethyl-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-(4-chlorophenyl)sulfonyl-N-ethylpiperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-(4-chlorophenyl)sulfonyl-N-ethyl-nipecotamide Formula: C21H22ClN3O3S2 MolecularWeight: 464.00068

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O3S2/c1-2-25(21-23-18-7-3-4-8-19(18)29-21)20(26)15-6-5-13-24(14-15)30(27,28)17-11-9-16(22)10-12-17/h3-4,7-12,15H,2,5-6,13-14H2,1H3