2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[3-[(2,5-dimethylphenyl)methylsulfonyl]-1-indolyl]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[3-(2,5-dimethylbenzyl)sulfonylindol-1-yl]-1-(4-phenylpiperazino)ethanone Formula: C29H31N3O3S MolecularWeight: 501.63974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)C)CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N3O3S/c1-22-12-13-23(2)24(18-22)21-36(34,35)28-19-32(27-11-7-6-10-26(27)28)20-29(33)31-16-14-30(15-17-31)25-8-4-3-5-9-25/h3-13,18-19H,14-17,20-21H2,1-2H3