ethyl 5-aminocarbonyl-2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-2-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-2-[4-(4-chloro-2-methylphenoxy)butanoylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H23ClN2O5S MolecularWeight: 438.92502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CCCOC2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CCCOC2=C(C=C(C=C2)Cl)C

InChI

InChI=1S/C20H23ClN2O5S/c1-4-27-20(26)16-12(3)17(18(22)25)29-19(16)23-15(24)6-5-9-28-14-8-7-13(21)10-11(14)2/h7-8,10H,4-6,9H2,1-3H3,(H2,22,25)(H,23,24)