ethyl 4-(4-fluorophenyl)-2-(pyrrolidin-1-ylcarbothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-fluorophenyl)-2-(pyrrolidin-1-ylcarbothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-fluorophenyl)-2-(pyrrolidine-1-carbothioylamino)thiophene-3-carboxylate CAS Name: 4-(4-fluorophenyl)-2-[[1-pyrrolidinyl(sulfanylidene)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-fluorophenyl)-2-(pyrrolidine-1-carbothioylamino)thiophene-3-carboxylate Traditional Name: 4-(4-fluorophenyl)-2-(pyrrolidine-1-carbothioylamino)thiophene-3-carboxylic acid ethyl ester Formula: C18H19FN2O2S2 MolecularWeight: 378.484063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=S)N3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=S)N3CCCC3

InChI

InChI=1S/C18H19FN2O2S2/c1-2-23-17(22)15-14(12-5-7-13(19)8-6-12)11-25-16(15)20-18(24)21-9-3-4-10-21/h5-8,11H,2-4,9-10H2,1H3,(H,20,24)