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

Systemtic Name: 5-(2-methoxyethylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid Openeye Name: 5-(2-methoxyethylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid CAS Name: 5-[(2-methoxyethylamino)-oxomethyl]-4-methyl-2-[[(octylamino)-oxomethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 5-(2-methoxyethylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid Traditional Name: 5-(2-methoxyethylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)-3-thenoic acid Formula: C19H31N3O5S MolecularWeight: 413.53154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31N3O5S/c1-4-5-6-7-8-9-10-21-19(26)22-17-14(18(24)25)13(2)15(28-17)16(23)20-11-12-27-3/h4-12H2,1-3H3,(H,20,23)(H,24,25)(H2,21,22,26)