4-[(E)-3-oxidanylidene-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-oxidanylidene-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-oxo-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]prop-1-enyl]benzonitrile CAS Name: 4-[(E)-3-oxo-3-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]prop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-oxo-3-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]prop-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-keto-3-(4-mesitylsulfonylpiperazino)prop-1-enyl]benzonitrile Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C=CC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)/C=C/C3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C23H25N3O3S/c1-17-14-18(2)23(19(3)15-17)30(28,29)26-12-10-25(11-13-26)22(27)9-8-20-4-6-21(16-24)7-5-20/h4-9,14-15H,10-13H2,1-3H3/b9-8+