4-[4-methyl-3-(2-phenylethynyl)-5-(1H-pyrazol-5-yl)thiophen-2-yl]morpholine

Systemtic Name: 4-[4-methyl-3-(2-phenylethynyl)-5-(1H-pyrazol-5-yl)thiophen-2-yl]morpholine Openeye Name: 4-[4-methyl-3-(2-phenylethynyl)-5-(1H-pyrazol-5-yl)-2-thienyl]morpholine CAS Name: 4-[4-methyl-3-(2-phenylethynyl)-5-(1H-pyrazol-5-yl)-2-thiophenyl]morpholine IUPAC Name: 4-[4-methyl-3-(2-phenylethynyl)-5-(1H-pyrazol-5-yl)thiophen-2-yl]morpholine Traditional Name: 4-[4-methyl-3-(2-phenylethynyl)-5-(1H-pyrazol-5-yl)-2-thienyl]morpholine Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#CC2=CC=CC=C2)N3CCOCC3)C4=CC=NN4

Isomeric SMILES

CC1=C(SC(=C1C#CC2=CC=CC=C2)N3CCOCC3)C4=CC=NN4

InChI

InChI=1S/C20H19N3OS/c1-15-17(8-7-16-5-3-2-4-6-16)20(23-11-13-24-14-12-23)25-19(15)18-9-10-21-22-18/h2-6,9-10H,11-14H2,1H3,(H,21,22)