ethyl 5-aminocarbonyl-2-[2-[(4-fluorophenyl)methylamino]ethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-2-[2-[(4-fluorophenyl)methylamino]ethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-2-[[2-[(4-fluorophenyl)methylamino]acetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-2-[[2-[(4-fluorophenyl)methylamino]-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-2-[[2-[(4-fluorophenyl)methylamino]acetyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[[2-[(4-fluorobenzyl)amino]acetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H20FN3O4S MolecularWeight: 393.432503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CNCC2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CNCC2=CC=C(C=C2)F

InChI

InChI=1S/C18H20FN3O4S/c1-3-26-18(25)14-10(2)15(16(20)24)27-17(14)22-13(23)9-21-8-11-4-6-12(19)7-5-11/h4-7,21H,3,8-9H2,1-2H3,(H2,20,24)(H,22,23)