N-[[(3S)-1-(3,5-dimethylfuran-2-yl)carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide

Systemtic Name: N-[[(3S)-1-(3,5-dimethylfuran-2-yl)carbonylpiperidin-3-yl]methyl]thiophene-2-sulfonamide Openeye Name: N-[[(3S)-1-(3,5-dimethylfuran-2-carbonyl)-3-piperidyl]methyl]thiophene-2-sulfonamide CAS Name: N-[[(3S)-1-[(3,5-dimethyl-2-furanyl)-oxomethyl]-3-piperidinyl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[[(3S)-1-(3,5-dimethylfuran-2-carbonyl)piperidin-3-yl]methyl]thiophene-2-sulfonamide Traditional Name: N-[[(3S)-1-(3,5-dimethyl-2-furoyl)-3-piperidyl]methyl]thiophene-2-sulfonamide Formula: C17H22N2O4S2 MolecularWeight: 382.49758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C(=O)N2CCCC(C2)CNS(=O)(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=C(O1)C(=O)N2CCC[C@@H](C2)CNS(=O)(=O)C3=CC=CS3)C

InChI

InChI=1S/C17H22N2O4S2/c1-12-9-13(2)23-16(12)17(20)19-7-3-5-14(11-19)10-18-25(21,22)15-6-4-8-24-15/h4,6,8-9,14,18H,3,5,7,10-11H2,1-2H3/t14-/m1/s1