N-cyclopropyl-5-[6-[2-[1-[(2-methylphenyl)methyl]indol-3-yl]ethylamino]purin-9-yl]-3,4-bis(oxidanyl)oxolane-2-carboxamide

Systemtic Name: N-cyclopropyl-5-[6-[2-[1-[(2-methylphenyl)methyl]indol-3-yl]ethylamino]purin-9-yl]-3,4-bis(oxidanyl)oxolane-2-carboxamide Openeye Name: N-cyclopropyl-3,4-dihydroxy-5-[6-[2-[1-(o-tolylmethyl)indol-3-yl]ethylamino]purin-9-yl]tetrahydrofuran-2-carboxamide CAS Name: N-cyclopropyl-3,4-dihydroxy-5-[6-[2-[1-[(2-methylphenyl)methyl]-3-indolyl]ethylamino]-9-purinyl]-2-oxolanecarboxamide IUPAC Name: N-cyclopropyl-3,4-dihydroxy-5-[6-[2-[1-[(2-methylphenyl)methyl]indol-3-yl]ethylamino]purin-9-yl]oxolane-2-carboxamide Traditional Name: N-cyclopropyl-3,4-dihydroxy-5-[6-[2-[1-(2-methylbenzyl)indol-3-yl]ethylamino]purin-9-yl]tetrahydrofuran-2-carboxamide Formula: C31H33N7O4 MolecularWeight: 567.63822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C3=CC=CC=C32)CCNC4=NC=NC5=C4N=CN5C6C(C(C(O6)C(=O)NC7CC7)O)O

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C3=CC=CC=C32)CCNC4=NC=NC5=C4N=CN5C6C(C(C(O6)C(=O)NC7CC7)O)O

InChI

InChI=1S/C31H33N7O4/c1-18-6-2-3-7-19(18)14-37-15-20(22-8-4-5-9-23(22)37)12-13-32-28-24-29(34-16-33-28)38(17-35-24)31-26(40)25(39)27(42-31)30(41)36-21-10-11-21/h2-9,15-17,21,25-27,31,39-40H,10-14H2,1H3,(H,36,41)(H,32,33,34)