methyl-[2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(3-methylthiophen-2-yl)methyl]azanium

Systemtic Name: methyl-[2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(3-methylthiophen-2-yl)methyl]azanium Openeye Name: methyl-[2-(2-methyl-5-morpholinosulfonyl-anilino)-2-oxo-ethyl]-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: methyl-[2-[2-methyl-5-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: methyl-[2-(2-methyl-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl]-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: [2-keto-2-(2-methyl-5-morpholinosulfonyl-anilino)ethyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium Formula: C20H28N3O4S2+ MolecularWeight: 438.58402

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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=C(C=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C[NH+](C)CC3=C(C=CS3)C

InChI

InChI=1S/C20H27N3O4S2/c1-15-4-5-17(29(25,26)23-7-9-27-10-8-23)12-18(15)21-20(24)14-22(3)13-19-16(2)6-11-28-19/h4-6,11-12H,7-10,13-14H2,1-3H3,(H,21,24)/p+1