ethyl 5-[2-[(3-fluorophenyl)methyl-methyl-amino]ethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[2-[(3-fluorophenyl)methyl-methyl-amino]ethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[2-[(3-fluorophenyl)methyl-methyl-amino]acetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-[(3-fluorophenyl)methyl-methylamino]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-[(3-fluorophenyl)methyl-methylamino]acetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[[2-[(3-fluorobenzyl)-methyl-amino]acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C18H21FN2O3S MolecularWeight: 364.434343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CN(C)CC2=CC(=CC=C2)F)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CN(C)CC2=CC(=CC=C2)F)C

InChI

InChI=1S/C18H21FN2O3S/c1-4-24-18(23)17-12(2)8-16(25-17)20-15(22)11-21(3)10-13-6-5-7-14(19)9-13/h5-9H,4,10-11H2,1-3H3,(H,20,22)