(E)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-N-prop-2-enyl-but-2-enamide

Systemtic Name: (E)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-N-prop-2-enyl-but-2-enamide Openeye Name: (E)-N-allyl-4-oxo-4-[4-(p-tolylsulfonyl)piperazin-1-yl]but-2-enamide CAS Name: (E)-4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-4-oxo-N-prop-2-enyl-2-butenamide IUPAC Name: (E)-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-oxo-N-prop-2-enylbut-2-enamide Traditional Name: (E)-N-allyl-4-keto-4-(4-tosylpiperazino)but-2-enamide Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C=CC(=O)NCC=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)/C=C/C(=O)NCC=C

InChI

InChI=1S/C18H23N3O4S/c1-3-10-19-17(22)8-9-18(23)20-11-13-21(14-12-20)26(24,25)16-6-4-15(2)5-7-16/h3-9H,1,10-14H2,2H3,(H,19,22)/b9-8+