N-(5-chloranyl-2-methoxy-phenyl)-2-(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanyl-acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[(2-phenyl-4-pyrazolo[1,5-a]pyrazinyl)thio]acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanylacetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)thio]acetamide Formula: C21H17ClN4O2S MolecularWeight: 424.90328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC=CN3C2=CC(=N3)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC=CN3C2=CC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H17ClN4O2S/c1-28-19-8-7-15(22)11-17(19)24-20(27)13-29-21-18-12-16(14-5-3-2-4-6-14)25-26(18)10-9-23-21/h2-12H,13H2,1H3,(H,24,27)