N-(2-methylsulfanylphenyl)-2-(3-morpholin-4-ylcarbonyl-5-thiophen-2-yl-pyrazol-1-yl)ethanamide

Systemtic Name: N-(2-methylsulfanylphenyl)-2-(3-morpholin-4-ylcarbonyl-5-thiophen-2-yl-pyrazol-1-yl)ethanamide Openeye Name: N-(2-methylsulfanylphenyl)-2-[3-(morpholine-4-carbonyl)-5-(2-thienyl)pyrazol-1-yl]acetamide CAS Name: N-[2-(methylthio)phenyl]-2-[3-[4-morpholinyl(oxo)methyl]-5-thiophen-2-yl-1-pyrazolyl]acetamide IUPAC Name: N-(2-methylsulfanylphenyl)-2-[3-(morpholine-4-carbonyl)-5-thiophen-2-ylpyrazol-1-yl]acetamide Traditional Name: N-[2-(methylthio)phenyl]-2-[3-(morpholine-4-carbonyl)-5-(2-thienyl)pyrazol-1-yl]acetamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)CN2C(=CC(=N2)C(=O)N3CCOCC3)C4=CC=CS4

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)CN2C(=CC(=N2)C(=O)N3CCOCC3)C4=CC=CS4

InChI

InChI=1S/C21H22N4O3S2/c1-29-18-6-3-2-5-15(18)22-20(26)14-25-17(19-7-4-12-30-19)13-16(23-25)21(27)24-8-10-28-11-9-24/h2-7,12-13H,8-11,14H2,1H3,(H,22,26)