methyl-[(5-methylfuran-2-yl)methyl]-[2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: methyl-[(5-methylfuran-2-yl)methyl]-[2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: methyl-[(5-methyl-2-furyl)methyl]-[2-(2-methyl-5-morpholinosulfonyl-anilino)-2-oxo-ethyl]ammonium CAS Name: methyl-[(5-methyl-2-furanyl)methyl]-[2-[2-methyl-5-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]ammonium IUPAC Name: methyl-[(5-methylfuran-2-yl)methyl]-[2-(2-methyl-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: [2-keto-2-(2-methyl-5-morpholinosulfonyl-anilino)ethyl]-methyl-[(5-methyl-2-furyl)methyl]ammonium Formula: C20H28N3O5S+ MolecularWeight: 422.51842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+](C)CC3=CC=C(O3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+](C)CC3=CC=C(O3)C

InChI

InChI=1S/C20H27N3O5S/c1-15-4-7-18(29(25,26)23-8-10-27-11-9-23)12-19(15)21-20(24)14-22(3)13-17-6-5-16(2)28-17/h4-7,12H,8-11,13-14H2,1-3H3,(H,21,24)/p+1