furan-2-ylmethyl-[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: furan-2-ylmethyl-[2-oxidanylidene-2-[(4-piperidin-1-ylsulfonylphenyl)amino]ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: 2-furylmethyl-[2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl]-(2-thienylmethyl)ammonium CAS Name: 2-furanylmethyl-[2-oxo-2-[4-(1-piperidinylsulfonyl)anilino]ethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: furan-2-ylmethyl-[2-oxo-2-(4-piperidin-1-ylsulfonylanilino)ethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: 2-furfuryl-[2-keto-2-(4-piperidinosulfonylanilino)ethyl]-(2-thenyl)ammonium Formula: C23H28N3O4S2+ MolecularWeight: 474.61612

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+](CC3=CC=CO3)CC4=CC=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[NH+](CC3=CC=CO3)CC4=CC=CS4

InChI

InChI=1S/C23H27N3O4S2/c27-23(18-25(16-20-6-4-14-30-20)17-21-7-5-15-31-21)24-19-8-10-22(11-9-19)32(28,29)26-12-2-1-3-13-26/h4-11,14-15H,1-3,12-13,16-18H2,(H,24,27)/p+1