4-(2,5-dimethylpiperazin-1-yl)-2-ethyl-1-(phenylsulfonyl)indole

Systemtic Name: 4-(2,5-dimethylpiperazin-1-yl)-2-ethyl-1-(phenylsulfonyl)indole Openeye Name: 1-(benzenesulfonyl)-4-(2,5-dimethylpiperazin-1-yl)-2-ethyl-indole CAS Name: 1-(benzenesulfonyl)-4-(2,5-dimethyl-1-piperazinyl)-2-ethylindole IUPAC Name: 1-(benzenesulfonyl)-4-(2,5-dimethylpiperazin-1-yl)-2-ethylindole Traditional Name: 1-besyl-4-(2,5-dimethylpiperazino)-2-ethyl-indole Formula: C22H27N3O2S MolecularWeight: 397.53368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N1S(=O)(=O)C3=CC=CC=C3)C=CC=C2N4CC(NCC4C)C

Isomeric SMILES

CCC1=CC2=C(N1S(=O)(=O)C3=CC=CC=C3)C=CC=C2N4CC(NCC4C)C

InChI

InChI=1S/C22H27N3O2S/c1-4-18-13-20-21(24-15-16(2)23-14-17(24)3)11-8-12-22(20)25(18)28(26,27)19-9-6-5-7-10-19/h5-13,16-17,23H,4,14-15H2,1-3H3