(5-methylthiophen-2-yl)methyl-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-phenethyl-azanium

Systemtic Name: (5-methylthiophen-2-yl)methyl-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-phenethyl-azanium Openeye Name: [2-(isoxazol-3-ylamino)-2-oxo-ethyl]-[(5-methyl-2-thienyl)methyl]-phenethyl-ammonium CAS Name: [2-(3-isoxazolylamino)-2-oxoethyl]-[(5-methyl-2-thiophenyl)methyl]-phenethylammonium IUPAC Name: (5-methylthiophen-2-yl)methyl-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-phenethylazanium Traditional Name: [2-(isoxazol-3-ylamino)-2-keto-ethyl]-[(5-methyl-2-thienyl)methyl]-phenethyl-ammonium Formula: C19H22N3O2S+ MolecularWeight: 356.46188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C[NH+](CCC2=CC=CC=C2)CC(=O)NC3=NOC=C3

Isomeric SMILES

CC1=CC=C(S1)C[NH+](CCC2=CC=CC=C2)CC(=O)NC3=NOC=C3

InChI

InChI=1S/C19H21N3O2S/c1-15-7-8-17(25-15)13-22(11-9-16-5-3-2-4-6-16)14-19(23)20-18-10-12-24-21-18/h2-8,10,12H,9,11,13-14H2,1H3,(H,20,21,23)/p+1