2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-N-(4-ethoxy-3-methoxy-phenyl)ethanamide

Systemtic Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-N-(4-ethoxy-3-methoxy-phenyl)ethanamide Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-N-(4-ethoxy-3-methoxy-phenyl)acetamide CAS Name: 2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)thio]-N-(4-ethoxy-3-methoxyphenyl)acetamide IUPAC Name: 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfanyl-N-(4-ethoxy-3-methoxyphenyl)acetamide Traditional Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)thio]-N-(4-ethoxy-3-methoxy-phenyl)acetamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSC2=C(N(N=C2C)C3=CC=CC=C3)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSC2=C(N(N=C2C)C3=CC=CC=C3)C)OC

InChI

InChI=1S/C22H25N3O3S/c1-5-28-19-12-11-17(13-20(19)27-4)23-21(26)14-29-22-15(2)24-25(16(22)3)18-9-7-6-8-10-18/h6-13H,5,14H2,1-4H3,(H,23,26)