7-heptan-4-yl-2,5,6-trimethyl-4-(2,4,6-trimethylphenoxy)pyrrolo[2,3-d]pyrimidine

Systemtic Name: 7-heptan-4-yl-2,5,6-trimethyl-4-(2,4,6-trimethylphenoxy)pyrrolo[2,3-d]pyrimidine Openeye Name: 2,5,6-trimethyl-7-(1-propylbutyl)-4-(2,4,6-trimethylphenoxy)pyrrolo[2,3-d]pyrimidine CAS Name: 7-heptan-4-yl-2,5,6-trimethyl-4-(2,4,6-trimethylphenoxy)pyrrolo[2,3-d]pyrimidine IUPAC Name: 7-heptan-4-yl-2,5,6-trimethyl-4-(2,4,6-trimethylphenoxy)pyrrolo[2,3-d]pyrimidine Traditional Name: 2,5,6-trimethyl-7-(1-propylbutyl)-4-(2,4,6-trimethylphenoxy)pyrrolo[2,3-d]pyrimidine Formula: C25H35N3O MolecularWeight: 393.5649

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N1C(=C(C2=C1N=C(N=C2OC3=C(C=C(C=C3C)C)C)C)C)C

Isomeric SMILES

CCCC(CCC)N1C(=C(C2=C1N=C(N=C2OC3=C(C=C(C=C3C)C)C)C)C)C

InChI

InChI=1S/C25H35N3O/c1-9-11-21(12-10-2)28-19(7)18(6)22-24(28)26-20(8)27-25(22)29-23-16(4)13-15(3)14-17(23)5/h13-14,21H,9-12H2,1-8H3