ethyl 5-phenyl-2-[2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-phenyl-2-[2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-phenyl-2-[2-(tetralin-1-ylamino)propanoylamino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-2-[2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)propanoylamino]thiophene-3-carboxylate Traditional Name: 5-phenyl-2-[2-(tetralin-1-ylamino)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C26H28N2O3S MolecularWeight: 448.57712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)NC3CCCC4=CC=CC=C34

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)NC3CCCC4=CC=CC=C34

InChI

InChI=1S/C26H28N2O3S/c1-3-31-26(30)21-16-23(19-11-5-4-6-12-19)32-25(21)28-24(29)17(2)27-22-15-9-13-18-10-7-8-14-20(18)22/h4-8,10-12,14,16-17,22,27H,3,9,13,15H2,1-2H3,(H,28,29)