8-chloranyl-1,3-bis(cyclopropylmethyl)-7-(naphthalen-1-ylmethyl)purine-2,6-dione

Systemtic Name: 8-chloranyl-1,3-bis(cyclopropylmethyl)-7-(naphthalen-1-ylmethyl)purine-2,6-dione Openeye Name: 8-chloro-1,3-bis(cyclopropylmethyl)-7-(1-naphthylmethyl)purine-2,6-dione CAS Name: 8-chloro-1,3-bis(cyclopropylmethyl)-7-(1-naphthalenylmethyl)purine-2,6-dione IUPAC Name: 8-chloro-1,3-bis(cyclopropylmethyl)-7-(naphthalen-1-ylmethyl)purine-2,6-dione Traditional Name: 8-chloro-1,3-bis(cyclopropylmethyl)-7-(1-naphthylmethyl)xanthine Formula: C24H23ClN4O2 MolecularWeight: 434.91802

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C3=C(C(=O)N(C2=O)CC4CC4)N(C(=N3)Cl)CC5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1CC1CN2C3=C(C(=O)N(C2=O)CC4CC4)N(C(=N3)Cl)CC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C24H23ClN4O2/c25-23-26-21-20(27(23)14-18-6-3-5-17-4-1-2-7-19(17)18)22(30)29(13-16-10-11-16)24(31)28(21)12-15-8-9-15/h1-7,15-16H,8-14H2