5-[4-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]piperazin-1-yl]sulfonylfuran-2-carboxamide

Systemtic Name: 5-[4-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]piperazin-1-yl]sulfonylfuran-2-carboxamide Openeye Name: 5-[4-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]piperazin-1-yl]sulfonylfuran-2-carboxamide CAS Name: 5-[[4-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]-1-piperazinyl]sulfonyl]-2-furancarboxamide IUPAC Name: 5-[4-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]piperazin-1-yl]sulfonylfuran-2-carboxamide Traditional Name: 5-[4-[4-(pyrrolidine-1-carbonyl)benzyl]piperazino]sulfonyl-2-furamide Formula: C21H26N4O5S MolecularWeight: 446.51994

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(O4)C(=O)N

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=C(O4)C(=O)N

InChI

InChI=1S/C21H26N4O5S/c22-20(26)18-7-8-19(30-18)31(28,29)25-13-11-23(12-14-25)15-16-3-5-17(6-4-16)21(27)24-9-1-2-10-24/h3-8H,1-2,9-15H2,(H2,22,26)