N-(3-methylbutyl)-2-(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-methylbutyl)-2-(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanyl-ethanamide Openeye Name: N-isopentyl-2-(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanyl-acetamide CAS Name: N-(3-methylbutyl)-2-[(2-phenyl-4-pyrazolo[1,5-a]pyrazinyl)thio]acetamide IUPAC Name: N-(3-methylbutyl)-2-(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)sulfanylacetamide Traditional Name: N-isoamyl-2-[(2-phenylpyrazolo[1,5-a]pyrazin-4-yl)thio]acetamide Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CSC1=NC=CN2C1=CC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCNC(=O)CSC1=NC=CN2C1=CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C19H22N4OS/c1-14(2)8-9-20-18(24)13-25-19-17-12-16(15-6-4-3-5-7-15)22-23(17)11-10-21-19/h3-7,10-12,14H,8-9,13H2,1-2H3,(H,20,24)