dimethyl-[(1R)-2-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]carbonylamino]-1-thiophen-2-yl-ethyl]azanium

Systemtic Name: dimethyl-[(1R)-2-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]carbonylamino]-1-thiophen-2-yl-ethyl]azanium Openeye Name: dimethyl-[(1R)-2-[[5-(p-tolyl)isoxazole-3-carbonyl]amino]-1-(2-thienyl)ethyl]ammonium CAS Name: dimethyl-[(1R)-2-[[[5-(4-methylphenyl)-3-isoxazolyl]-oxomethyl]amino]-1-thiophen-2-ylethyl]ammonium IUPAC Name: dimethyl-[(1R)-2-[[5-(4-methylphenyl)-1,2-oxazole-3-carbonyl]amino]-1-thiophen-2-ylethyl]azanium Traditional Name: dimethyl-[(1R)-2-[[5-(p-tolyl)isoxazole-3-carbonyl]amino]-1-(2-thienyl)ethyl]ammonium Formula: C19H22N3O2S+ MolecularWeight: 356.46188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NCC(C3=CC=CS3)[NH+](C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC[C@H](C3=CC=CS3)[NH+](C)C

InChI

InChI=1S/C19H21N3O2S/c1-13-6-8-14(9-7-13)17-11-15(21-24-17)19(23)20-12-16(22(2)3)18-5-4-10-25-18/h4-11,16H,12H2,1-3H3,(H,20,23)/p+1/t16-/m1/s1