N-[(4-imidazol-1-ylphenyl)methyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[(4-imidazol-1-ylphenyl)methyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Openeye Name: N-[(4-imidazol-1-ylphenyl)methyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide CAS Name: N-[[4-(1-imidazolyl)phenyl]methyl]-1-(3-phenylpropylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-[(4-imidazol-1-ylphenyl)methyl]-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide Traditional Name: N-(4-imidazol-1-ylbenzyl)-1-(3-phenylpropylsulfonyl)nipecotamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C25H30N4O3S/c30-25(27-18-22-10-12-24(13-11-22)28-16-14-26-20-28)23-9-4-15-29(19-23)33(31,32)17-5-8-21-6-2-1-3-7-21/h1-3,6-7,10-14,16,20,23H,4-5,8-9,15,17-19H2,(H,27,30)