ethyl 3-[2-[2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoyl]oxyethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-[2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoyl]oxyethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-[2-[(4-chlorobenzoyl)amino]-4-methyl-pentanoyl]oxyacetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[2-[[(4-chlorophenyl)-oxomethyl]amino]-4-methyl-1-oxopentoxy]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[2-[(4-chlorobenzoyl)amino]-4-methylpentanoyl]oxyacetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-[2-[(4-chlorobenzoyl)amino]-4-methyl-pentanoyl]oxyacetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C28H29ClN2O6S MolecularWeight: 557.05766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC(=O)C(CC(C)C)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC(=O)C(CC(C)C)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C28H29ClN2O6S/c1-4-36-28(35)25-21(15-23(38-25)18-8-6-5-7-9-18)30-24(32)16-37-27(34)22(14-17(2)3)31-26(33)19-10-12-20(29)13-11-19/h5-13,15,17,22H,4,14,16H2,1-3H3,(H,30,32)(H,31,33)