N-[2-methyl-7-(4-phenylsulfanylpiperidin-1-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-4-(2-oxidanylpropan-2-yl)benzamide

Systemtic Name: N-[2-methyl-7-(4-phenylsulfanylpiperidin-1-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-4-(2-oxidanylpropan-2-yl)benzamide Openeye Name: 4-(1-hydroxy-1-methyl-ethyl)-N-[2-methyl-7-(4-phenylsulfanyl-1-piperidyl)pyrazolo[1,5-a]pyrimidin-5-yl]benzamide CAS Name: 4-(2-hydroxypropan-2-yl)-N-[2-methyl-7-[4-(phenylthio)-1-piperidinyl]-5-pyrazolo[1,5-a]pyrimidinyl]benzamide IUPAC Name: 4-(2-hydroxypropan-2-yl)-N-[2-methyl-7-(4-phenylsulfanylpiperidin-1-yl)pyrazolo[1,5-a]pyrimidin-5-yl]benzamide Traditional Name: 4-(1-hydroxy-1-methyl-ethyl)-N-[2-methyl-7-[4-(phenylthio)piperidino]pyrazolo[1,5-a]pyrimidin-5-yl]benzamide Formula: C28H31N5O2S MolecularWeight: 501.64304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=C1)N=C(C=C2N3CCC(CC3)SC4=CC=CC=C4)NC(=O)C5=CC=C(C=C5)C(C)(C)O

Isomeric SMILES

CC1=NN2C(=C1)N=C(C=C2N3CCC(CC3)SC4=CC=CC=C4)NC(=O)C5=CC=C(C=C5)C(C)(C)O

InChI

InChI=1S/C28H31N5O2S/c1-19-17-25-29-24(30-27(34)20-9-11-21(12-10-20)28(2,3)35)18-26(33(25)31-19)32-15-13-23(14-16-32)36-22-7-5-4-6-8-22/h4-12,17-18,23,35H,13-16H2,1-3H3,(H,29,30,34)