(3S)-3-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]propylsulfonylmethyl]-4-naphthalen-2-ylsulfonyl-piperazin-2-one

Systemtic Name: (3S)-3-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]propylsulfonylmethyl]-4-naphthalen-2-ylsulfonyl-piperazin-2-one Openeye Name: (3S)-3-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]propylsulfonylmethyl]-4-(2-naphthylsulfonyl)piperazin-2-one CAS Name: (3S)-3-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]propylsulfonylmethyl]-4-(2-naphthalenylsulfonyl)-2-piperazinone IUPAC Name: (3S)-3-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]propylsulfonylmethyl]-4-naphthalen-2-ylsulfonylpiperazin-2-one Traditional Name: (3S)-3-[3-[4-(2-imidazolin-2-yl)phenyl]propylsulfonylmethyl]-4-(2-naphthylsulfonyl)piperazin-2-one Formula: C27H30N4O5S2 MolecularWeight: 554.6809

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)C2=CC=C(C=C2)CCCS(=O)(=O)CC3C(=O)NCCN3S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN=C(N1)C2=CC=C(C=C2)CCCS(=O)(=O)C[C@@H]3C(=O)NCCN3S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H30N4O5S2/c32-27-25(19-37(33,34)17-3-4-20-7-9-22(10-8-20)26-28-13-14-29-26)31(16-15-30-27)38(35,36)24-12-11-21-5-1-2-6-23(21)18-24/h1-2,5-12,18,25H,3-4,13-17,19H2,(H,28,29)(H,30,32)/t25-/m1/s1