N-[2-(4-pyrazol-1-ylphenyl)ethyl]-4-(thiophen-3-ylmethyl)piperazine-1-carboxamide

Systemtic Name: N-[2-(4-pyrazol-1-ylphenyl)ethyl]-4-(thiophen-3-ylmethyl)piperazine-1-carboxamide Openeye Name: N-[2-(4-pyrazol-1-ylphenyl)ethyl]-4-(3-thienylmethyl)piperazine-1-carboxamide CAS Name: N-[2-[4-(1-pyrazolyl)phenyl]ethyl]-4-(3-thiophenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-[2-(4-pyrazol-1-ylphenyl)ethyl]-4-(thiophen-3-ylmethyl)piperazine-1-carboxamide Traditional Name: N-[2-(4-pyrazol-1-ylphenyl)ethyl]-4-(3-thenyl)piperazine-1-carboxamide Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C21H25N5OS/c27-21(25-13-11-24(12-14-25)16-19-7-15-28-17-19)22-9-6-18-2-4-20(5-3-18)26-10-1-8-23-26/h1-5,7-8,10,15,17H,6,9,11-14,16H2,(H,22,27)