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

Systemtic Name: 5-(cyclohexylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid Openeye Name: 5-(cyclohexylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid CAS Name: 5-[(cyclohexylamino)-oxomethyl]-4-methyl-2-[[(octylamino)-oxomethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 5-(cyclohexylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)thiophene-3-carboxylic acid Traditional Name: 5-(cyclohexylcarbamoyl)-4-methyl-2-(octylcarbamoylamino)-3-thenoic acid Formula: C22H35N3O4S MolecularWeight: 437.596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)NC1=C(C(=C(S1)C(=O)NC2CCCCC2)C)C(=O)O

Isomeric SMILES

CCCCCCCCNC(=O)NC1=C(C(=C(S1)C(=O)NC2CCCCC2)C)C(=O)O

InChI

InChI=1S/C22H35N3O4S/c1-3-4-5-6-7-11-14-23-22(29)25-20-17(21(27)28)15(2)18(30-20)19(26)24-16-12-9-8-10-13-16/h16H,3-14H2,1-2H3,(H,24,26)(H,27,28)(H2,23,25,29)