(2R)-2-[[6-[methyl-(phenylmethyl)amino]-9-propan-2-yl-purin-2-yl]amino]but-3-enal

Systemtic Name: (2R)-2-[[6-[methyl-(phenylmethyl)amino]-9-propan-2-yl-purin-2-yl]amino]but-3-enal Openeye Name: (2R)-2-[[6-[benzyl(methyl)amino]-9-isopropyl-purin-2-yl]amino]but-3-enal CAS Name: (2R)-2-[[6-[methyl-(phenylmethyl)amino]-9-propan-2-yl-2-purinyl]amino]-3-butenal IUPAC Name: (2R)-2-[[6-[benzyl(methyl)amino]-9-propan-2-ylpurin-2-yl]amino]but-3-enal Traditional Name: (2R)-2-[[6-[benzyl(methyl)amino]-9-isopropyl-purin-2-yl]amino]but-3-enal Formula: C20H24N6O MolecularWeight: 364.44416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2N(C)CC3=CC=CC=C3)NC(C=C)C=O

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2N(C)CC3=CC=CC=C3)N[C@H](C=C)C=O

InChI

InChI=1S/C20H24N6O/c1-5-16(12-27)22-20-23-18(25(4)11-15-9-7-6-8-10-15)17-19(24-20)26(13-21-17)14(2)3/h5-10,12-14,16H,1,11H2,2-4H3,(H,22,23,24)/t16-/m1/s1