N-[2-[3-[(3-chlorophenyl)methyl]imidazol-4-yl]ethyl]-4-hexyl-1-methylsulfinyl-piperazine-2-carboxamide

Systemtic Name: N-[2-[3-[(3-chlorophenyl)methyl]imidazol-4-yl]ethyl]-4-hexyl-1-methylsulfinyl-piperazine-2-carboxamide Openeye Name: N-[2-[3-[(3-chlorophenyl)methyl]imidazol-4-yl]ethyl]-4-hexyl-1-methylsulfinyl-piperazine-2-carboxamide CAS Name: N-[2-[3-[(3-chlorophenyl)methyl]-4-imidazolyl]ethyl]-4-hexyl-1-methylsulfinyl-2-piperazinecarboxamide IUPAC Name: N-[2-[3-[(3-chlorophenyl)methyl]imidazol-4-yl]ethyl]-4-hexyl-1-methylsulfinylpiperazine-2-carboxamide Traditional Name: N-[2-[3-(3-chlorobenzyl)imidazol-4-yl]ethyl]-4-hexyl-1-methylsulfinyl-piperazine-2-carboxamide Formula: C24H36ClN5O2S MolecularWeight: 494.09294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCN(C(C1)C(=O)NCCC2=CN=CN2CC3=CC(=CC=C3)Cl)S(=O)C

Isomeric SMILES

CCCCCCN1CCN(C(C1)C(=O)NCCC2=CN=CN2CC3=CC(=CC=C3)Cl)S(=O)C

InChI

InChI=1S/C24H36ClN5O2S/c1-3-4-5-6-12-28-13-14-30(33(2)32)23(18-28)24(31)27-11-10-22-16-26-19-29(22)17-20-8-7-9-21(25)15-20/h7-9,15-16,19,23H,3-6,10-14,17-18H2,1-2H3,(H,27,31)