(3S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(phenylmethyl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(phenylmethyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-benzyl-piperidine-3-carboxamide CAS Name: (3S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(phenylmethyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-benzylpiperidine-3-carboxamide Traditional Name: (3S)-N-benzyl-1-piazthiol-4-ylsulfonyl-nipecotamide Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC3=NSN=C32)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC3=NSN=C32)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C19H20N4O3S2/c24-19(20-12-14-6-2-1-3-7-14)15-8-5-11-23(13-15)28(25,26)17-10-4-9-16-18(17)22-27-21-16/h1-4,6-7,9-10,15H,5,8,11-13H2,(H,20,24)/t15-/m0/s1