(3R)-1-butylsulfonyl-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide

Systemtic Name: (3R)-1-butylsulfonyl-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide Openeye Name: (3R)-N-(5-benzyl-1,3,4-thiadiazol-2-yl)-1-butylsulfonyl-piperidine-3-carboxamide CAS Name: (3R)-1-butylsulfonyl-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-3-piperidinecarboxamide IUPAC Name: (3R)-N-(5-benzyl-1,3,4-thiadiazol-2-yl)-1-butylsulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-(5-benzyl-1,3,4-thiadiazol-2-yl)-1-butylsulfonyl-nipecotamide Formula: C19H26N4O3S2 MolecularWeight: 422.56474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCCC(C1)C(=O)NC2=NN=C(S2)CC3=CC=CC=C3

Isomeric SMILES

CCCCS(=O)(=O)N1CCC[C@H](C1)C(=O)NC2=NN=C(S2)CC3=CC=CC=C3

InChI

InChI=1S/C19H26N4O3S2/c1-2-3-12-28(25,26)23-11-7-10-16(14-23)18(24)20-19-22-21-17(27-19)13-15-8-5-4-6-9-15/h4-6,8-9,16H,2-3,7,10-14H2,1H3,(H,20,22,24)/t16-/m1/s1