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

Systemtic Name: N'-[4,5-bis(4-methoxyphenyl)pyrimidin-2-yl]-4-(phenylmethyl)piperidine-1-carboximidamide Openeye Name: 4-benzyl-N'-[4,5-bis(4-methoxyphenyl)pyrimidin-2-yl]piperidine-1-carboxamidine CAS Name: N'-[4,5-bis(4-methoxyphenyl)-2-pyrimidinyl]-4-(phenylmethyl)-1-piperidinecarboximidamide IUPAC Name: 4-benzyl-N'-[4,5-bis(4-methoxyphenyl)pyrimidin-2-yl]piperidine-1-carboximidamide Traditional Name: 4-benzyl-N'-[4,5-bis(4-methoxyphenyl)pyrimidin-2-yl]piperidine-1-carboxamidine Formula: C31H33N5O2 MolecularWeight: 507.62602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(N=C2C3=CC=C(C=C3)OC)N=C(N)N4CCC(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)/N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C31H33N5O2/c1-37-26-12-8-24(9-13-26)28-21-33-31(34-29(28)25-10-14-27(38-2)15-11-25)35-30(32)36-18-16-23(17-19-36)20-22-6-4-3-5-7-22/h3-15,21,23H,16-20H2,1-2H3,(H2,32,33,34,35)