N-(2-methylphenyl)-2-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl-propyl-amino]ethanamide

Systemtic Name: N-(2-methylphenyl)-2-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl-propyl-amino]ethanamide Openeye Name: N-(o-tolyl)-2-[[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]-propyl-amino]acetamide CAS Name: N-(2-methylphenyl)-2-[[1-oxo-2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]ethyl]-propylamino]acetamide IUPAC Name: N-(2-methylphenyl)-2-[[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]-propylamino]acetamide Traditional Name: N-(o-tolyl)-2-[[2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetyl]-propyl-amino]acetamide Formula: C25H26N6O2S MolecularWeight: 474.57794

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C25H26N6O2S/c1-3-13-30(15-22(32)29-21-12-8-7-9-18(21)2)23(33)16-34-25-20-14-28-31(24(20)26-17-27-25)19-10-5-4-6-11-19/h4-12,14,17H,3,13,15-16H2,1-2H3,(H,29,32)