N-[2-[5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl]sulfanylethyl]ethanamide

Systemtic Name: N-[2-[5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl]sulfanylethyl]ethanamide Openeye Name: N-[2-[5-phenyl-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl]sulfanylethyl]acetamide CAS Name: N-[2-[[5-phenyl-7-(3-pyridinylmethylamino)-3-pyrazolo[1,5-a]pyrimidinyl]thio]ethyl]acetamide IUPAC Name: N-[2-[5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl]sulfanylethyl]acetamide Traditional Name: N-[2-[[5-phenyl-7-(3-pyridylmethylamino)pyrazolo[1,5-a]pyrimidin-3-yl]thio]ethyl]acetamide Formula: C22H22N6OS MolecularWeight: 418.51468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCSC1=C2N=C(C=C(N2N=C1)NCC3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCSC1=C2N=C(C=C(N2N=C1)NCC3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N6OS/c1-16(29)24-10-11-30-20-15-26-28-21(25-14-17-6-5-9-23-13-17)12-19(27-22(20)28)18-7-3-2-4-8-18/h2-9,12-13,15,25H,10-11,14H2,1H3,(H,24,29)