N-[4-[butyl(furan-2-ylmethyl)amino]-3-pyrrolidin-1-ylcarbonyl-phenyl]methanesulfonamide

Systemtic Name: N-[4-[butyl(furan-2-ylmethyl)amino]-3-pyrrolidin-1-ylcarbonyl-phenyl]methanesulfonamide Openeye Name: N-[4-[butyl(2-furylmethyl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]methanesulfonamide CAS Name: N-[4-[butyl(2-furanylmethyl)amino]-3-[oxo(1-pyrrolidinyl)methyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[butyl(furan-2-ylmethyl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]methanesulfonamide Traditional Name: N-[4-[butyl(2-furfuryl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]methanesulfonamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NS(=O)(=O)C)C(=O)N3CCCC3

Isomeric SMILES

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NS(=O)(=O)C)C(=O)N3CCCC3

InChI

InChI=1S/C21H29N3O4S/c1-3-4-11-24(16-18-8-7-14-28-18)20-10-9-17(22-29(2,26)27)15-19(20)21(25)23-12-5-6-13-23/h7-10,14-15,22H,3-6,11-13,16H2,1-2H3