3-(4-methylpiperazin-1-yl)-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: 3-(4-methylpiperazin-1-yl)-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-(4-methylpiperazin-1-yl)prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-(4-methyl-1-piperazinyl)-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-(4-methylpiperazin-1-yl)prop-2-enenitrile Traditional Name: 2-besyl-3-(4-methylpiperazino)acrylonitrile Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CN1CCN(CC1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H17N3O2S/c1-16-7-9-17(10-8-16)12-14(11-15)20(18,19)13-5-3-2-4-6-13/h2-6,12H,7-10H2,1H3