N-[3-(imidazol-1-ylmethyl)phenyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-(4-isopropylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(1-imidazolylmethyl)phenyl]-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-p-cumenylsulfonyl-isonipecotamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)CN4C=CN=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)CN4C=CN=C4

InChI

InChI=1S/C25H30N4O3S/c1-19(2)21-6-8-24(9-7-21)33(31,32)29-13-10-22(11-14-29)25(30)27-23-5-3-4-20(16-23)17-28-15-12-26-18-28/h3-9,12,15-16,18-19,22H,10-11,13-14,17H2,1-2H3,(H,27,30)