5-(dimethylcarbamoylamino)-3-[(4-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carboxylic acid

Systemtic Name: 5-(dimethylcarbamoylamino)-3-[(4-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carboxylic acid Openeye Name: 5-(dimethylcarbamoylamino)-3-[(4-methoxyphenyl)methylsulfanyl]isothiazole-4-carboxylic acid CAS Name: 5-[[dimethylamino(oxo)methyl]amino]-3-[(4-methoxyphenyl)methylthio]-4-isothiazolecarboxylic acid IUPAC Name: 5-(dimethylcarbamoylamino)-3-[(4-methoxyphenyl)methylsulfanyl]-1,2-thiazole-4-carboxylic acid Traditional Name: 5-(dimethylcarbamoylamino)-3-(p-anisylthio)isothiazole-4-carboxylic acid Formula: C15H17N3O4S2 MolecularWeight: 367.44318

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC1=C(C(=NS1)SCC2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CN(C)C(=O)NC1=C(C(=NS1)SCC2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C15H17N3O4S2/c1-18(2)15(21)16-12-11(14(19)20)13(17-24-12)23-8-9-4-6-10(22-3)7-5-9/h4-7H,8H2,1-3H3,(H,16,21)(H,19,20)