5-(dimethylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid

Systemtic Name: 5-(dimethylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid Openeye Name: 5-(dimethylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid CAS Name: 5-[dimethylamino(oxo)methyl]-4-methyl-2-[[(octylamino)-oxomethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 5-(dimethylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid Traditional Name: 5-(dimethylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)-3-thenoic acid Formula: C18H29N3O4S MolecularWeight: 383.50556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)NC1=C(C(=C(S1)C(=O)N(C)C)C)C(=O)O

Isomeric SMILES

CCCCCCCCNC(=O)NC1=C(C(=C(S1)C(=O)N(C)C)C)C(=O)O

InChI

InChI=1S/C18H29N3O4S/c1-5-6-7-8-9-10-11-19-18(25)20-15-13(17(23)24)12(2)14(26-15)16(22)21(3)4/h5-11H2,1-4H3,(H,23,24)(H2,19,20,25)