4-[4-methyl-5-(2-methylpyrazol-3-yl)-3-(2-phenylethynyl)thiophen-2-yl]morpholine

Systemtic Name: 4-[4-methyl-5-(2-methylpyrazol-3-yl)-3-(2-phenylethynyl)thiophen-2-yl]morpholine Openeye Name: 4-[4-methyl-5-(2-methylpyrazol-3-yl)-3-(2-phenylethynyl)-2-thienyl]morpholine CAS Name: 4-[4-methyl-5-(2-methyl-3-pyrazolyl)-3-(2-phenylethynyl)-2-thiophenyl]morpholine IUPAC Name: 4-[4-methyl-5-(2-methylpyrazol-3-yl)-3-(2-phenylethynyl)thiophen-2-yl]morpholine Traditional Name: 4-[4-methyl-5-(2-methylpyrazol-3-yl)-3-(2-phenylethynyl)-2-thienyl]morpholine Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#CC2=CC=CC=C2)N3CCOCC3)C4=CC=NN4C

Isomeric SMILES

CC1=C(SC(=C1C#CC2=CC=CC=C2)N3CCOCC3)C4=CC=NN4C

InChI

InChI=1S/C21H21N3OS/c1-16-18(9-8-17-6-4-3-5-7-17)21(24-12-14-25-15-13-24)26-20(16)19-10-11-22-23(19)2/h3-7,10-11H,12-15H2,1-2H3