4-[[4-[3-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[3-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[3-[(2,6-dimethyl-4-morpholinyl)sulfonyl]phenyl]-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[3-(2,6-dimethylmorpholino)sulfonylbenzoyl]piperazino]methyl]benzonitrile Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H30N4O4S/c1-19-16-29(17-20(2)33-19)34(31,32)24-5-3-4-23(14-24)25(30)28-12-10-27(11-13-28)18-22-8-6-21(15-26)7-9-22/h3-9,14,19-20H,10-13,16-18H2,1-2H3