ethyl 3-(4-cyclopropylthiophen-2-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate

Systemtic Name: ethyl 3-(4-cyclopropylthiophen-2-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate Openeye Name: ethyl 3-(4-cyclopropyl-2-thienyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate CAS Name: 3-(4-cyclopropyl-2-thiophenyl)-1-[[3-(trifluoromethyl)phenyl]methyl]-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-cyclopropylthiophen-2-yl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylate Traditional Name: 3-(4-cyclopropyl-2-thienyl)-1-[3-(trifluoromethyl)benzyl]indole-2-carboxylic acid ethyl ester Formula: C26H22F3NO2S MolecularWeight: 469.51859

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)C(F)(F)F)C4=CC(=CS4)C5CC5

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)C(F)(F)F)C4=CC(=CS4)C5CC5

InChI

InChI=1S/C26H22F3NO2S/c1-2-32-25(31)24-23(22-13-18(15-33-22)17-10-11-17)20-8-3-4-9-21(20)30(24)14-16-6-5-7-19(12-16)26(27,28)29/h3-9,12-13,15,17H,2,10-11,14H2,1H3