methyl 3-[2-[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]amino]acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[ethyl-(3-fluoro-4-methoxy-benzyl)amino]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C18H21FN2O4S MolecularWeight: 380.433743

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=C(SC=C2)C(=O)OC

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)CC(=O)NC2=C(SC=C2)C(=O)OC

InChI

InChI=1S/C18H21FN2O4S/c1-4-21(10-12-5-6-15(24-2)13(19)9-12)11-16(22)20-14-7-8-26-17(14)18(23)25-3/h5-9H,4,10-11H2,1-3H3,(H,20,22)