1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(2S)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(2S)-1-(furan-2-ylmethylamino)-1-oxidanylidene-propan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(1S)-2-(2-furylmethylamino)-1-methyl-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(2S)-1-(2-furanylmethylamino)-1-oxopropan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(2S)-1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide Traditional Name: N-[(1S)-2-(2-furfurylamino)-2-keto-1-methyl-ethyl]-1-piazthiol-4-ylsulfonyl-isonipecotamide Formula: C20H23N5O5S2 MolecularWeight: 477.55712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CO1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C20H23N5O5S2/c1-13(19(26)21-12-15-4-3-11-30-15)22-20(27)14-7-9-25(10-8-14)32(28,29)17-6-2-5-16-18(17)24-31-23-16/h2-6,11,13-14H,7-10,12H2,1H3,(H,21,26)(H,22,27)/t13-/m0/s1