3-(1H-indol-3-yl)-1-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(1H-indol-3-yl)-1-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(1H-indol-3-yl)-1-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(1H-indol-3-yl)-1-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-(1H-indol-3-yl)-1-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(1H-indol-3-yl)-1-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazino]propan-1-one Formula: C25H31N3O3S MolecularWeight: 453.59694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CNC4=CC=CC=C43)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CNC4=CC=CC=C43)C)C

InChI

InChI=1S/C25H31N3O3S/c1-17-15-18(2)20(4)25(19(17)3)32(30,31)28-13-11-27(12-14-28)24(29)10-9-21-16-26-23-8-6-5-7-22(21)23/h5-8,15-16,26H,9-14H2,1-4H3