N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-1-naphthalen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-1-naphthalen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-1-(2-naphthylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(1R)-1-[4-(1-imidazolyl)phenyl]ethyl]-1-(2-naphthalenylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-1-(2-naphthylsulfonyl)isonipecotamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)N2C=CN=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H28N4O3S/c1-20(21-6-9-25(10-7-21)30-17-14-28-19-30)29-27(32)23-12-15-31(16-13-23)35(33,34)26-11-8-22-4-2-3-5-24(22)18-26/h2-11,14,17-20,23H,12-13,15-16H2,1H3,(H,29,32)/t20-/m1/s1