2-[4-[1-(furan-2-ylcarbonyl)pyrrolidin-2-yl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[1-(furan-2-ylcarbonyl)pyrrolidin-2-yl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[1-(furan-2-carbonyl)pyrrolidine-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[[1-[2-furanyl(oxo)methyl]-2-pyrrolidinyl]-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[1-(furan-2-carbonyl)pyrrolidine-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[1-(2-furoyl)prolyl]piperazino]sulfonylbenzonitrile Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CO2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC=CO2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C21H22N4O5S/c22-15-16-5-1-2-8-19(16)31(28,29)24-12-10-23(11-13-24)20(26)17-6-3-9-25(17)21(27)18-7-4-14-30-18/h1-2,4-5,7-8,14,17H,3,6,9-13H2