(5-chloranylthiophen-2-yl)methyl-[2-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[2-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (5-chloro-2-thienyl)methyl-[2-[4-methoxy-3-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[2-[4-methoxy-3-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]-methylammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[2-(4-methoxy-3-piperidin-1-ylsulfonylanilino)-2-oxoethyl]-methylazanium Traditional Name: (5-chloro-2-thienyl)methyl-[2-keto-2-(4-methoxy-3-piperidinosulfonyl-anilino)ethyl]-methyl-ammonium Formula: C20H27ClN3O4S2+ MolecularWeight: 473.02908

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(S1)Cl)CC(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[NH+](CC1=CC=C(S1)Cl)CC(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H26ClN3O4S2/c1-23(13-16-7-9-19(21)29-16)14-20(25)22-15-6-8-17(28-2)18(12-15)30(26,27)24-10-4-3-5-11-24/h6-9,12H,3-5,10-11,13-14H2,1-2H3,(H,22,25)/p+1