3-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-1-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]propan-1-one

Systemtic Name: 3-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-1-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]propan-1-one Openeye Name: 3-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-1-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]propan-1-one CAS Name: 3-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-1-[4-(4-methylsulfonyl-1-piperazinyl)phenyl]-1-propanone IUPAC Name: 3-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-1-[4-(4-methylsulfonylpiperazin-1-yl)phenyl]propan-1-one Traditional Name: 3-[4-(2-imidazolin-2-ylamino)phenyl]-1-[4-(4-mesylpiperazino)phenyl]propan-1-one Formula: C23H29N5O3S MolecularWeight: 455.57306

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)C(=O)CCC3=CC=C(C=C3)NC4=NCCN4

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)C(=O)CCC3=CC=C(C=C3)NC4=NCCN4

InChI

InChI=1S/C23H29N5O3S/c1-32(30,31)28-16-14-27(15-17-28)21-9-5-19(6-10-21)22(29)11-4-18-2-7-20(8-3-18)26-23-24-12-13-25-23/h2-3,5-10H,4,11-17H2,1H3,(H2,24,25,26)