4-(pyridin-4-ylmethyl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(pyridin-4-ylmethyl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-(4-pyridylmethyl)-N-[2-(3-thienylmethylsulfanyl)phenyl]piperazine-1-carboxamide CAS Name: 4-(pyridin-4-ylmethyl)-N-[2-(3-thiophenylmethylthio)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(pyridin-4-ylmethyl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-(4-pyridylmethyl)-N-[2-(3-thenylthio)phenyl]piperazine-1-carboxamide Formula: C22H24N4OS2 MolecularWeight: 424.58216

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)NC3=CC=CC=C3SCC4=CSC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)NC3=CC=CC=C3SCC4=CSC=C4

InChI

InChI=1S/C22H24N4OS2/c27-22(26-12-10-25(11-13-26)15-18-5-8-23-9-6-18)24-20-3-1-2-4-21(20)29-17-19-7-14-28-16-19/h1-9,14,16H,10-13,15,17H2,(H,24,27)