(4E)-2-phenyl-5-propyl-4-(thiophen-2-ylmethylidene)pyrazol-3-one

Systemtic Name: (4E)-2-phenyl-5-propyl-4-(thiophen-2-ylmethylidene)pyrazol-3-one Openeye Name: (4E)-2-phenyl-5-propyl-4-(2-thienylmethylene)pyrazol-3-one CAS Name: (4E)-2-phenyl-5-propyl-4-(thiophen-2-ylmethylidene)-3-pyrazolone IUPAC Name: (4E)-2-phenyl-5-propyl-4-(thiophen-2-ylmethylidene)pyrazol-3-one Traditional Name: (4E)-2-phenyl-5-propyl-4-(2-thenylidene)-2-pyrazolin-3-one Formula: C17H16N2OS MolecularWeight: 296.38674

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=CC2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C/C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C17H16N2OS/c1-2-7-16-15(12-14-10-6-11-21-14)17(20)19(18-16)13-8-4-3-5-9-13/h3-6,8-12H,2,7H2,1H3/b15-12+