N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: N-[2-(2-furylmethylamino)-2-oxo-ethyl]-4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzamide CAS Name: N-[2-(2-furanylmethylamino)-2-oxoethyl]-4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzamide Traditional Name: N-[2-(2-furfurylamino)-2-keto-ethyl]-4-[(3S)-3-methylpiperidino]sulfonyl-benzamide Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(=O)NCC3=CC=CO3

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H25N3O5S/c1-15-4-2-10-23(14-15)29(26,27)18-8-6-16(7-9-18)20(25)22-13-19(24)21-12-17-5-3-11-28-17/h3,5-9,11,15H,2,4,10,12-14H2,1H3,(H,21,24)(H,22,25)/t15-/m0/s1