ethyl 2-azanyl-5-(4-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-5-(4-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]thiophene-3-carboxylate Openeye Name: ethyl 2-amino-5-(4-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]thiophene-3-carboxylate CAS Name: 2-amino-5-(4-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-5-(4-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]thiophene-3-carboxylate Traditional Name: 2-amino-5-(4-methoxyphenyl)-4-[3-(trifluoromethyl)phenyl]thiophene-3-carboxylic acid ethyl ester Formula: C21H18F3NO3S MolecularWeight: 421.43273

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC(=CC=C2)C(F)(F)F)C3=CC=C(C=C3)OC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC(=CC=C2)C(F)(F)F)C3=CC=C(C=C3)OC)N

InChI

InChI=1S/C21H18F3NO3S/c1-3-28-20(26)17-16(13-5-4-6-14(11-13)21(22,23)24)18(29-19(17)25)12-7-9-15(27-2)10-8-12/h4-11H,3,25H2,1-2H3