1-(5-tert-butyl-2-methoxy-phenyl)-3-[4-[6-[2-dimethylaminoethyl(methyl)amino]purin-9-yl]naphthalen-1-yl]urea

Systemtic Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-[4-[6-[2-dimethylaminoethyl(methyl)amino]purin-9-yl]naphthalen-1-yl]urea Openeye Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-[4-[6-[2-dimethylaminoethyl(methyl)amino]purin-9-yl]-1-naphthyl]urea CAS Name: 1-(5-tert-butyl-2-methoxyphenyl)-3-[4-[6-[2-dimethylaminoethyl(methyl)amino]-9-purinyl]-1-naphthalenyl]urea IUPAC Name: 1-(5-tert-butyl-2-methoxyphenyl)-3-[4-[6-[2-dimethylaminoethyl(methyl)amino]purin-9-yl]naphthalen-1-yl]urea Traditional Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-[4-[6-[2-dimethylaminoethyl(methyl)amino]purin-9-yl]-1-naphthyl]urea Formula: C32H38N8O2 MolecularWeight: 566.69652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)N4C=NC5=C4N=CN=C5N(C)CCN(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)N4C=NC5=C4N=CN=C5N(C)CCN(C)C

InChI

InChI=1S/C32H38N8O2/c1-32(2,3)21-12-15-27(42-7)25(18-21)37-31(41)36-24-13-14-26(23-11-9-8-10-22(23)24)40-20-35-28-29(33-19-34-30(28)40)39(6)17-16-38(4)5/h8-15,18-20H,16-17H2,1-7H3,(H2,36,37,41)