2-[4-[[(4R)-4-cyclopropyl-4-methyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]methyl]piperazin-4-ium-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[[(4R)-4-cyclopropyl-4-methyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]methyl]piperazin-4-ium-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[[(4R)-4-cyclopropyl-4-methyl-2,5-dioxo-imidazolidin-1-yl]methyl]piperazin-4-ium-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[[(4R)-4-cyclopropyl-4-methyl-2,5-dioxo-1-imidazolidinyl]methyl]-1-piperazin-4-iumyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[[(4R)-4-cyclopropyl-4-methyl-2,5-dioxoimidazolidin-1-yl]methyl]piperazin-4-ium-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[[(4R)-4-cyclopropyl-2,5-diketo-4-methyl-imidazolidin-1-yl]methyl]piperazin-4-ium-1-yl]sulfonylbenzonitrile Formula: C19H24N5O4S+ MolecularWeight: 418.48996

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C4CC4

Isomeric SMILES

C[C@]1(C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C4CC4

InChI

InChI=1S/C19H23N5O4S/c1-19(15-6-7-15)17(25)24(18(26)21-19)13-22-8-10-23(11-9-22)29(27,28)16-5-3-2-4-14(16)12-20/h2-5,15H,6-11,13H2,1H3,(H,21,26)/p+1/t19-/m1/s1