ethyl 3-[2-(cyclooctylamino)ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-(cyclooctylamino)ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-(cyclooctylamino)acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-(cyclooctylamino)-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(cyclooctylamino)acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-(cyclooctylamino)acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C23H30N2O3S MolecularWeight: 414.5609

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CNC3CCCCCCC3

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CNC3CCCCCCC3

InChI

InChI=1S/C23H30N2O3S/c1-2-28-23(27)22-19(15-20(29-22)17-11-7-6-8-12-17)25-21(26)16-24-18-13-9-4-3-5-10-14-18/h6-8,11-12,15,18,24H,2-5,9-10,13-14,16H2,1H3,(H,25,26)