2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]oxybenzenecarbonitrile

Systemtic Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1-oxidanylidene-propan-2-yl]oxybenzenecarbonitrile Openeye Name: 2-[2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1-methyl-2-oxo-ethoxy]benzonitrile CAS Name: 2-[1-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-1-oxopropan-2-yl]oxybenzonitrile IUPAC Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]-1-oxopropan-2-yl]oxybenzonitrile Traditional Name: 2-[2-[4-(4-tert-butylphenyl)sulfonylpiperazino]-2-keto-1-methyl-ethoxy]benzonitrile Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)OC3=CC=CC=C3C#N

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)OC3=CC=CC=C3C#N

InChI

InChI=1S/C24H29N3O4S/c1-18(31-22-8-6-5-7-19(22)17-25)23(28)26-13-15-27(16-14-26)32(29,30)21-11-9-20(10-12-21)24(2,3)4/h5-12,18H,13-16H2,1-4H3