N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-[4-[(E)-styryl]sulfonylpiperazin-1-yl]acetamide CAS Name: N-[(1R)-1-cyano-1-cyclopropylethyl]-2-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-[(1R)-1-cyano-1-cyclopropylethyl]-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]acetamide Traditional Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-[4-[(E)-styryl]sulfonylpiperazino]acetamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)CN2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C[C@](C#N)(C1CC1)NC(=O)CN2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H26N4O3S/c1-20(16-21,18-7-8-18)22-19(25)15-23-10-12-24(13-11-23)28(26,27)14-9-17-5-3-2-4-6-17/h2-6,9,14,18H,7-8,10-13,15H2,1H3,(H,22,25)/b14-9+/t20-/m0/s1