ethyl 4-[2-[(4-fluorophenyl)methylamino]-1,3-thiazol-4-yl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-[(4-fluorophenyl)methylamino]-1,3-thiazol-4-yl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-[(4-fluorophenyl)methylamino]thiazol-4-yl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-[(4-fluorophenyl)methylamino]-4-thiazolyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-fluorophenyl)methylamino]-1,3-thiazol-4-yl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-[(4-fluorobenzyl)amino]thiazol-4-yl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C19H20FN3O2S MolecularWeight: 373.444403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CSC(=N2)NCC3=CC=C(C=C3)F)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CSC(=N2)NCC3=CC=C(C=C3)F)C)C

InChI

InChI=1S/C19H20FN3O2S/c1-4-25-18(24)17-12(3)22-11(2)16(17)15-10-26-19(23-15)21-9-13-5-7-14(20)8-6-13/h5-8,10,22H,4,9H2,1-3H3,(H,21,23)