N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[[4-(1-pyrazolylmethyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(pyrazol-1-ylmethyl)benzyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)CN3C=CC=N3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)CN3C=CC=N3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H24N4O3S2/c26-21(19-8-12-25(13-9-19)30(27,28)20-3-1-14-29-20)22-15-17-4-6-18(7-5-17)16-24-11-2-10-23-24/h1-7,10-11,14,19H,8-9,12-13,15-16H2,(H,22,26)