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

Systemtic Name: N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo(thiophen-2-yl)methyl]-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]-4-piperidinecarboxamide IUPAC Name: N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]-1-(2-thenoyl)isonipecotamide Formula: C22H24N4O2S3 MolecularWeight: 472.64656

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NN=C(S2)SCCCC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NN=C(S2)SCCCC3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H24N4O2S3/c27-19(17-10-12-26(13-11-17)20(28)18-9-5-14-29-18)23-21-24-25-22(31-21)30-15-4-8-16-6-2-1-3-7-16/h1-3,5-7,9,14,17H,4,8,10-13,15H2,(H,23,24,27)