N-[2-[[(2R)-1-oxidanylbutan-2-yl]amino]-9-propan-2-yl-purin-6-yl]benzamide

Systemtic Name: N-[2-[[(2R)-1-oxidanylbutan-2-yl]amino]-9-propan-2-yl-purin-6-yl]benzamide Openeye Name: N-[2-[[(1R)-1-(hydroxymethyl)propyl]amino]-9-isopropyl-purin-6-yl]benzamide CAS Name: N-[2-[[(2R)-1-hydroxybutan-2-yl]amino]-9-propan-2-yl-6-purinyl]benzamide IUPAC Name: N-[2-[[(2R)-1-hydroxybutan-2-yl]amino]-9-propan-2-ylpurin-6-yl]benzamide Traditional Name: N-[9-isopropyl-2-[[(1R)-1-methylolpropyl]amino]purin-6-yl]benzamide Formula: C19H24N6O2 MolecularWeight: 368.43286

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=NC2=C(C(=N1)NC(=O)C3=CC=CC=C3)N=CN2C(C)C

Isomeric SMILES

CC[C@H](CO)NC1=NC2=C(C(=N1)NC(=O)C3=CC=CC=C3)N=CN2C(C)C

InChI

InChI=1S/C19H24N6O2/c1-4-14(10-26)21-19-23-16(22-18(27)13-8-6-5-7-9-13)15-17(24-19)25(11-20-15)12(2)3/h5-9,11-12,14,26H,4,10H2,1-3H3,(H2,21,22,23,24,27)/t14-/m1/s1