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

Systemtic Name: 2-(dimethylcarbamoylamino)-4-[(4-methoxyphenyl)methylsulfanyl]thiophene-3-carboxylic acid Openeye Name: 2-(dimethylcarbamoylamino)-4-[(4-methoxyphenyl)methylsulfanyl]thiophene-3-carboxylic acid CAS Name: 2-[[dimethylamino(oxo)methyl]amino]-4-[(4-methoxyphenyl)methylthio]-3-thiophenecarboxylic acid IUPAC Name: 2-(dimethylcarbamoylamino)-4-[(4-methoxyphenyl)methylsulfanyl]thiophene-3-carboxylic acid Traditional Name: 2-(dimethylcarbamoylamino)-4-(p-anisylthio)-3-thenoic acid Formula: C16H18N2O4S2 MolecularWeight: 366.45512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4S2/c1-18(2)16(21)17-14-13(15(19)20)12(9-24-14)23-8-10-4-6-11(22-3)7-5-10/h4-7,9H,8H2,1-3H3,(H,17,21)(H,19,20)