(4-methylsulfonylpiperazin-1-yl)-[1-(phenylmethyl)indol-3-yl]methanone

Systemtic Name: (4-methylsulfonylpiperazin-1-yl)-[1-(phenylmethyl)indol-3-yl]methanone Openeye Name: (1-benzylindol-3-yl)-(4-methylsulfonylpiperazin-1-yl)methanone CAS Name: (4-methylsulfonyl-1-piperazinyl)-[1-(phenylmethyl)-3-indolyl]methanone IUPAC Name: (1-benzylindol-3-yl)-(4-methylsulfonylpiperazin-1-yl)methanone Traditional Name: (1-benzylindol-3-yl)-(4-mesylpiperazino)methanone Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3S/c1-28(26,27)24-13-11-22(12-14-24)21(25)19-16-23(15-17-7-3-2-4-8-17)20-10-6-5-9-18(19)20/h2-10,16H,11-15H2,1H3