N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo(thiophen-2-yl)methyl]-N-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]-4-piperidinecarboxamide IUPAC Name: N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]-1-(2-thenoyl)isonipecotamide Formula: C20H20N4O2S3 MolecularWeight: 444.5934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NN=C(S2)CSC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NN=C(S2)CSC3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C20H20N4O2S3/c25-18(14-8-10-24(11-9-14)19(26)16-7-4-12-27-16)21-20-23-22-17(29-20)13-28-15-5-2-1-3-6-15/h1-7,12,14H,8-11,13H2,(H,21,23,25)