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

Systemtic Name: (E)-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]-N-prop-2-enyl-but-2-enamide Openeye Name: (E)-N-allyl-4-[4-(benzenesulfonyl)piperazin-1-yl]-4-oxo-but-2-enamide CAS Name: (E)-4-[4-(benzenesulfonyl)-1-piperazinyl]-4-oxo-N-prop-2-enyl-2-butenamide IUPAC Name: (E)-4-[4-(benzenesulfonyl)piperazin-1-yl]-4-oxo-N-prop-2-enylbut-2-enamide Traditional Name: (E)-N-allyl-4-(4-besylpiperazino)-4-keto-but-2-enamide Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C=CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C=CCNC(=O)/C=C/C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H21N3O4S/c1-2-10-18-16(21)8-9-17(22)19-11-13-20(14-12-19)25(23,24)15-6-4-3-5-7-15/h2-9H,1,10-14H2,(H,18,21)/b9-8+