(E)-2-(4-bromophenyl)sulfonyl-3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(4-bromophenyl)sulfonyl-3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]prop-2-enenitrile Openeye Name: (E)-2-(4-bromophenyl)sulfonyl-3-[4-(furan-2-carbonyl)piperazin-1-yl]prop-2-enenitrile CAS Name: (E)-2-(4-bromophenyl)sulfonyl-3-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-propenenitrile IUPAC Name: (E)-2-(4-bromophenyl)sulfonyl-3-[4-(furan-2-carbonyl)piperazin-1-yl]prop-2-enenitrile Traditional Name: (E)-2-brosyl-3-[4-(2-furoyl)piperazino]acrylonitrile Formula: C18H16BrN3O4S MolecularWeight: 450.30634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CCN1/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)C3=CC=CO3

InChI

InChI=1S/C18H16BrN3O4S/c19-14-3-5-15(6-4-14)27(24,25)16(12-20)13-21-7-9-22(10-8-21)18(23)17-2-1-11-26-17/h1-6,11,13H,7-10H2/b16-13+