5-(dimethylcarbamoylamino)-3-[(4-ethenylphenyl)methoxy]-1,2-thiazole-4-carboxylic acid

Systemtic Name: 5-(dimethylcarbamoylamino)-3-[(4-ethenylphenyl)methoxy]-1,2-thiazole-4-carboxylic acid Openeye Name: 5-(dimethylcarbamoylamino)-3-[(4-vinylphenyl)methoxy]isothiazole-4-carboxylic acid CAS Name: 5-[[dimethylamino(oxo)methyl]amino]-3-[(4-ethenylphenyl)methoxy]-4-isothiazolecarboxylic acid IUPAC Name: 5-(dimethylcarbamoylamino)-3-[(4-ethenylphenyl)methoxy]-1,2-thiazole-4-carboxylic acid Traditional Name: 5-(dimethylcarbamoylamino)-3-(4-vinylbenzyl)oxy-isothiazole-4-carboxylic acid Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC1=C(C(=NS1)OCC2=CC=C(C=C2)C=C)C(=O)O

Isomeric SMILES

CN(C)C(=O)NC1=C(C(=NS1)OCC2=CC=C(C=C2)C=C)C(=O)O

InChI

InChI=1S/C16H17N3O4S/c1-4-10-5-7-11(8-6-10)9-23-13-12(15(20)21)14(24-18-13)17-16(22)19(2)3/h4-8H,1,9H2,2-3H3,(H,17,22)(H,20,21)