2-[5,5-bis(3-methoxyphenyl)pent-4-enyl]-5-butyl-pyrimidin-4-amine

Systemtic Name: 2-[5,5-bis(3-methoxyphenyl)pent-4-enyl]-5-butyl-pyrimidin-4-amine Openeye Name: 2-[5,5-bis(3-methoxyphenyl)pent-4-enyl]-5-butyl-pyrimidin-4-amine CAS Name: 2-[5,5-bis(3-methoxyphenyl)pent-4-enyl]-5-butyl-4-pyrimidinamine IUPAC Name: 2-[5,5-bis(3-methoxyphenyl)pent-4-enyl]-5-butylpyrimidin-4-amine Traditional Name: [2-[5,5-bis(3-methoxyphenyl)pent-4-enyl]-5-butyl-pyrimidin-4-yl]amine Formula: C27H33N3O2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1N)CCCC=C(C2=CC(=CC=C2)OC)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCC1=CN=C(N=C1N)CCCC=C(C2=CC(=CC=C2)OC)C3=CC(=CC=C3)OC

InChI

InChI=1S/C27H33N3O2/c1-4-5-10-22-19-29-26(30-27(22)28)16-7-6-15-25(20-11-8-13-23(17-20)31-2)21-12-9-14-24(18-21)32-3/h8-9,11-15,17-19H,4-7,10,16H2,1-3H3,(H2,28,29,30)