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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC2=NCCN2)C(=O)C3=CC=C(C=C3)N4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC(C1=CC=C(C=C1)NC2=NCCN2)C(=O)C3=CC=C(C=C3)N4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C23H29N5O3S/c1-17(18-3-7-20(8-4-18)26-23-24-11-12-25-23)22(29)19-5-9-21(10-6-19)27-13-15-28(16-14-27)32(2,30)31/h3-10,17H,11-16H2,1-2H3,(H2,24,25,26)