(4Z)-2-phenyl-5-propyl-4-[1-(2-thiophen-2-ylethylamino)ethylidene]pyrazol-3-one

Systemtic Name: (4Z)-2-phenyl-5-propyl-4-[1-(2-thiophen-2-ylethylamino)ethylidene]pyrazol-3-one Openeye Name: (4Z)-2-phenyl-5-propyl-4-[1-[2-(2-thienyl)ethylamino]ethylidene]pyrazol-3-one CAS Name: (4Z)-2-phenyl-5-propyl-4-[1-(2-thiophen-2-ylethylamino)ethylidene]-3-pyrazolone IUPAC Name: (4Z)-2-phenyl-5-propyl-4-[1-(2-thiophen-2-ylethylamino)ethylidene]pyrazol-3-one Traditional Name: (4Z)-2-phenyl-5-propyl-4-[1-[2-(2-thienyl)ethylamino]ethylidene]-2-pyrazolin-3-one Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NCCC2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NCCC2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C20H23N3OS/c1-3-8-18-19(15(2)21-13-12-17-11-7-14-25-17)20(24)23(22-18)16-9-5-4-6-10-16/h4-7,9-11,14,21H,3,8,12-13H2,1-2H3/b19-15-