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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCCOC2=C(C=C(C=C2)Cl)C)C(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCCOC2=C(C=C(C=C2)Cl)C)C(=O)N)C

InChI

InChI=1S/C20H23ClN2O5S/c1-4-27-20(26)17-12(3)16(18(22)25)19(29-17)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)