methyl 2-[(4Z)-5-oxidanylidene-1-phenyl-4-[1-(2-thiophen-2-ylethylamino)ethylidene]pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(4Z)-5-oxidanylidene-1-phenyl-4-[1-(2-thiophen-2-ylethylamino)ethylidene]pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[(4Z)-5-oxo-1-phenyl-4-[1-[2-(2-thienyl)ethylamino]ethylidene]pyrazol-3-yl]acetate CAS Name: 2-[(4Z)-5-oxo-1-phenyl-4-[1-(2-thiophen-2-ylethylamino)ethylidene]-3-pyrazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[(4Z)-5-oxo-1-phenyl-4-[1-(2-thiophen-2-ylethylamino)ethylidene]pyrazol-3-yl]acetate Traditional Name: 2-[(4Z)-5-keto-1-phenyl-4-[1-[2-(2-thienyl)ethylamino]ethylidene]-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)NCCC3=CC=CS3

Isomeric SMILES

C/C(=C/1\C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)/NCCC3=CC=CS3

InChI

InChI=1S/C20H21N3O3S/c1-14(21-11-10-16-9-6-12-27-16)19-17(13-18(24)26-2)22-23(20(19)25)15-7-4-3-5-8-15/h3-9,12,21H,10-11,13H2,1-2H3/b19-14-