N'-[4,5-bis(4-methoxyphenyl)pyrimidin-2-yl]-4-(phenylmethyl)piperazine-1-carboximidamide

Systemtic Name: N'-[4,5-bis(4-methoxyphenyl)pyrimidin-2-yl]-4-(phenylmethyl)piperazine-1-carboximidamide Openeye Name: 4-benzyl-N'-[4,5-bis(4-methoxyphenyl)pyrimidin-2-yl]piperazine-1-carboxamidine CAS Name: N'-[4,5-bis(4-methoxyphenyl)-2-pyrimidinyl]-4-(phenylmethyl)-1-piperazinecarboximidamide IUPAC Name: 4-benzyl-N'-[4,5-bis(4-methoxyphenyl)pyrimidin-2-yl]piperazine-1-carboximidamide Traditional Name: 4-benzyl-N'-[4,5-bis(4-methoxyphenyl)pyrimidin-2-yl]piperazine-1-carboxamidine Formula: C30H32N6O2 MolecularWeight: 508.61408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(N=C2C3=CC=C(C=C3)OC)N=C(N)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(N=C2C3=CC=C(C=C3)OC)/N=C(\N)/N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C30H32N6O2/c1-37-25-12-8-23(9-13-25)27-20-32-30(33-28(27)24-10-14-26(38-2)15-11-24)34-29(31)36-18-16-35(17-19-36)21-22-6-4-3-5-7-22/h3-15,20H,16-19,21H2,1-2H3,(H2,31,32,33,34)