N-[(2-imidazol-1-ylphenyl)methyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(2-imidazol-1-ylphenyl)methyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[(2-imidazol-1-ylphenyl)methyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-[[2-(1-imidazolyl)phenyl]methyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(2-imidazol-1-ylphenyl)methyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(2-imidazol-1-ylbenzyl)-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2N3C=CN=C3)S(=O)(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2N3C=CN=C3)S(=O)(=O)CCCC4=CC=CC=C4

InChI

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