2-(dimethylcarbamoylamino)-4-[(4-ethenylphenyl)methylsulfanyl]thiophene-3-carboxylic acid

Systemtic Name: 2-(dimethylcarbamoylamino)-4-[(4-ethenylphenyl)methylsulfanyl]thiophene-3-carboxylic acid Openeye Name: 2-(dimethylcarbamoylamino)-4-[(4-vinylphenyl)methylsulfanyl]thiophene-3-carboxylic acid CAS Name: 2-[[dimethylamino(oxo)methyl]amino]-4-[(4-ethenylphenyl)methylthio]-3-thiophenecarboxylic acid IUPAC Name: 2-(dimethylcarbamoylamino)-4-[(4-ethenylphenyl)methylsulfanyl]thiophene-3-carboxylic acid Traditional Name: 2-(dimethylcarbamoylamino)-4-[(4-vinylbenzyl)thio]-3-thenoic acid Formula: C17H18N2O3S2 MolecularWeight: 362.46642

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC1=C(C(=CS1)SCC2=CC=C(C=C2)C=C)C(=O)O

Isomeric SMILES

CN(C)C(=O)NC1=C(C(=CS1)SCC2=CC=C(C=C2)C=C)C(=O)O

InChI

InChI=1S/C17H18N2O3S2/c1-4-11-5-7-12(8-6-11)9-23-13-10-24-15(14(13)16(20)21)18-17(22)19(2)3/h4-8,10H,1,9H2,2-3H3,(H,18,22)(H,20,21)