N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-morpholin-4-yl-2-thiophen-2-yl-ethanamine

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-morpholin-4-yl-2-thiophen-2-yl-ethanamine Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-morpholino-2-(2-thienyl)ethanamine CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2-(4-morpholinyl)-2-thiophen-2-ylethanamine IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine Traditional Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-[2-morpholino-2-(2-thienyl)ethyl]amine Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNCC(C3=CC=CS3)N4CCOCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNCC(C3=CC=CS3)N4CCOCC4

InChI

InChI=1S/C22H28N4OS/c1-17-20(18(2)26(24-17)19-7-4-3-5-8-19)15-23-16-21(22-9-6-14-28-22)25-10-12-27-13-11-25/h3-9,14,21,23H,10-13,15-16H2,1-2H3