octyl 4-methyl-3-[2-(propylamino)propanoylamino]thiophene-2-carboxylate

Systemtic Name: octyl 4-methyl-3-[2-(propylamino)propanoylamino]thiophene-2-carboxylate Openeye Name: octyl 4-methyl-3-[2-(propylamino)propanoylamino]thiophene-2-carboxylate CAS Name: 4-methyl-3-[[1-oxo-2-(propylamino)propyl]amino]-2-thiophenecarboxylic acid octyl ester IUPAC Name: octyl 4-methyl-3-[2-(propylamino)propanoylamino]thiophene-2-carboxylate Traditional Name: 4-methyl-3-[2-(propylamino)propanoylamino]thiophene-2-carboxylic acid octyl ester Formula: C20H34N2O3S MolecularWeight: 382.56056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=C(C(=CS1)C)NC(=O)C(C)NCCC

Isomeric SMILES

CCCCCCCCOC(=O)C1=C(C(=CS1)C)NC(=O)C(C)NCCC

InChI

InChI=1S/C20H34N2O3S/c1-5-7-8-9-10-11-13-25-20(24)18-17(15(3)14-26-18)22-19(23)16(4)21-12-6-2/h14,16,21H,5-13H2,1-4H3,(H,22,23)