N-cyclopropyl-3-[6-[3-[ethanoyl(methyl)amino]pyrrolidin-1-yl]purin-9-yl]-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[6-[3-[ethanoyl(methyl)amino]pyrrolidin-1-yl]purin-9-yl]-4-methyl-benzamide Openeye Name: 3-[6-[3-[acetyl(methyl)amino]pyrrolidin-1-yl]purin-9-yl]-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-[6-[3-[acetyl(methyl)amino]-1-pyrrolidinyl]-9-purinyl]-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-[6-[3-[acetyl(methyl)amino]pyrrolidin-1-yl]purin-9-yl]-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-[6-[3-[acetyl(methyl)amino]pyrrolidino]purin-9-yl]-N-cyclopropyl-4-methyl-benzamide Formula: C23H27N7O2 MolecularWeight: 433.50618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C3N=CN=C4N5CCC(C5)N(C)C(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C3N=CN=C4N5CCC(C5)N(C)C(=O)C

InChI

InChI=1S/C23H27N7O2/c1-14-4-5-16(23(32)27-17-6-7-17)10-19(14)30-13-26-20-21(24-12-25-22(20)30)29-9-8-18(11-29)28(3)15(2)31/h4-5,10,12-13,17-18H,6-9,11H2,1-3H3,(H,27,32)