N-[(4-imidazol-1-ylphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-imidazol-1-ylphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-imidazol-1-ylphenyl)methyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[[4-(1-imidazolyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(4-imidazol-1-ylphenyl)methyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(4-imidazol-1-ylbenzyl)-1-(2-thienylsulfonyl)isonipecotamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)N3C=CN=C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)N3C=CN=C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H22N4O3S2/c25-20(22-14-16-3-5-18(6-4-16)23-12-9-21-15-23)17-7-10-24(11-8-17)29(26,27)19-2-1-13-28-19/h1-6,9,12-13,15,17H,7-8,10-11,14H2,(H,22,25)