2-(dimethylcarbamoylamino)-4-(naphthalen-1-ylmethylsulfanyl)thiophene-3-carboxylic acid

Systemtic Name: 2-(dimethylcarbamoylamino)-4-(naphthalen-1-ylmethylsulfanyl)thiophene-3-carboxylic acid Openeye Name: 2-(dimethylcarbamoylamino)-4-(1-naphthylmethylsulfanyl)thiophene-3-carboxylic acid CAS Name: 2-[[dimethylamino(oxo)methyl]amino]-4-(1-naphthalenylmethylthio)-3-thiophenecarboxylic acid IUPAC Name: 2-(dimethylcarbamoylamino)-4-(naphthalen-1-ylmethylsulfanyl)thiophene-3-carboxylic acid Traditional Name: 2-(dimethylcarbamoylamino)-4-(1-naphthylmethylthio)-3-thenoic acid Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC1=C(C(=CS1)SCC2=CC=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CN(C)C(=O)NC1=C(C(=CS1)SCC2=CC=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C19H18N2O3S2/c1-21(2)19(24)20-17-16(18(22)23)15(11-26-17)25-10-13-8-5-7-12-6-3-4-9-14(12)13/h3-9,11H,10H2,1-2H3,(H,20,24)(H,22,23)