2-(dimethylcarbamoylamino)-4-phenethylsulfanyl-thiophene-3-carboxylic acid

Systemtic Name: 2-(dimethylcarbamoylamino)-4-phenethylsulfanyl-thiophene-3-carboxylic acid Openeye Name: 2-(dimethylcarbamoylamino)-4-phenethylsulfanyl-thiophene-3-carboxylic acid CAS Name: 2-[[dimethylamino(oxo)methyl]amino]-4-(phenethylthio)-3-thiophenecarboxylic acid IUPAC Name: 2-(dimethylcarbamoylamino)-4-phenethylsulfanylthiophene-3-carboxylic acid Traditional Name: 2-(dimethylcarbamoylamino)-4-(phenethylthio)-3-thenoic acid Formula: C16H18N2O3S2 MolecularWeight: 350.45572

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC1=C(C(=CS1)SCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CN(C)C(=O)NC1=C(C(=CS1)SCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H18N2O3S2/c1-18(2)16(21)17-14-13(15(19)20)12(10-23-14)22-9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,17,21)(H,19,20)