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

Systemtic Name: 1-(4-chlorophenyl)carbonyl-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide Openeye Name: 1-(4-chlorobenzoyl)-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-chlorobenzoyl)-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxamide Traditional Name: 1-(4-chlorobenzoyl)-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]isonipecotamide Formula: C24H25ClN4O2S2 MolecularWeight: 501.0639

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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=C(C=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C24H25ClN4O2S2/c25-20-10-8-19(9-11-20)22(31)29-14-12-18(13-15-29)21(30)26-23-27-28-24(33-23)32-16-4-7-17-5-2-1-3-6-17/h1-3,5-6,8-11,18H,4,7,12-16H2,(H,26,27,30)