2,1,3-benzothiadiazol-5-ylmethyl-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-methyl-azanium

Systemtic Name: 2,1,3-benzothiadiazol-5-ylmethyl-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-methyl-azanium Openeye Name: 2,1,3-benzothiadiazol-5-ylmethyl-[[2-(2-ethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-methyl-ammonium CAS Name: 2,1,3-benzothiadiazol-5-ylmethyl-[[2-(2-ethoxyphenyl)-5-methyl-4-oxazolyl]methyl]-methylammonium IUPAC Name: 2,1,3-benzothiadiazol-5-ylmethyl-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-methylazanium Traditional Name: methyl-[(5-methyl-2-o-phenetyl-oxazol-4-yl)methyl]-(piazthiol-5-ylmethyl)ammonium Formula: C21H23N4O2S+ MolecularWeight: 395.49792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC(=C(O2)C)C[NH+](C)CC3=CC4=NSN=C4C=C3

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC(=C(O2)C)C[NH+](C)CC3=CC4=NSN=C4C=C3

InChI

InChI=1S/C21H22N4O2S/c1-4-26-20-8-6-5-7-16(20)21-22-19(14(2)27-21)13-25(3)12-15-9-10-17-18(11-15)24-28-23-17/h5-11H,4,12-13H2,1-3H3/p+1