4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]benzonitrile CAS Name: 4-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]benzonitrile IUPAC Name: 4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]benzonitrile Traditional Name: 4-[4-(4-methoxyphenyl)sulfonylpiperazino]benzonitrile Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H19N3O3S/c1-24-17-6-8-18(9-7-17)25(22,23)21-12-10-20(11-13-21)16-4-2-15(14-19)3-5-16/h2-9H,10-13H2,1H3