N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-(4-methoxyphenyl)sulfanyl-ethanamide

Systemtic Name: N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-(4-methoxyphenyl)sulfanyl-ethanamide Openeye Name: N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-(4-methoxyphenyl)sulfanyl-acetamide CAS Name: N-(5-cyclopropyl-2-phenyl-3-pyrazolyl)-2-[(4-methoxyphenyl)thio]acetamide IUPAC Name: N-(5-cyclopropyl-2-phenylpyrazol-3-yl)-2-(4-methoxyphenyl)sulfanylacetamide Traditional Name: N-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-2-[(4-methoxyphenyl)thio]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C21H21N3O2S/c1-26-17-9-11-18(12-10-17)27-14-21(25)22-20-13-19(15-7-8-15)23-24(20)16-5-3-2-4-6-16/h2-6,9-13,15H,7-8,14H2,1H3,(H,22,25)