[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(1R)-1-thiophen-2-ylethyl]azanium

Systemtic Name: [2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(1R)-1-thiophen-2-ylethyl]azanium Openeye Name: [2-(2-methoxy-5-methyl-anilino)-2-oxo-ethyl]-methyl-[(1R)-1-(2-thienyl)ethyl]ammonium CAS Name: [2-(2-methoxy-5-methylanilino)-2-oxoethyl]-methyl-[(1R)-1-thiophen-2-ylethyl]ammonium IUPAC Name: [2-(2-methoxy-5-methylanilino)-2-oxoethyl]-methyl-[(1R)-1-thiophen-2-ylethyl]azanium Traditional Name: [2-keto-2-(2-methoxy-5-methyl-anilino)ethyl]-methyl-[(1R)-1-(2-thienyl)ethyl]ammonium Formula: C17H23N2O2S+ MolecularWeight: 319.44172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C[NH+](C)C(C)C2=CC=CS2

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C[NH+](C)[C@H](C)C2=CC=CS2

InChI

InChI=1S/C17H22N2O2S/c1-12-7-8-15(21-4)14(10-12)18-17(20)11-19(3)13(2)16-6-5-9-22-16/h5-10,13H,11H2,1-4H3,(H,18,20)/p+1/t13-/m1/s1