N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)sulfonyl-N-methyl-piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)sulfonyl-N-methyl-piperidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)sulfonyl-N-methyl-piperidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)sulfonyl-N-methyl-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)sulfonyl-N-methylpiperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(4-fluorophenyl)sulfonyl-N-methyl-nipecotamide Formula: C21H22FN3O3S2 MolecularWeight: 447.546083

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3O3S2/c1-24(14-20-23-18-6-2-3-7-19(18)29-20)21(26)15-5-4-12-25(13-15)30(27,28)17-10-8-16(22)9-11-17/h2-3,6-11,15H,4-5,12-14H2,1H3