N'-[5-[[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methyl]-2-methyl-pyrimidin-4-yl]-N,N-bis(phenylmethyl)methanimidamide

Systemtic Name: N'-[5-[[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methyl]-2-methyl-pyrimidin-4-yl]-N,N-bis(phenylmethyl)methanimidamide Openeye Name: N,N-dibenzyl-N'-[5-[[5-(2-hydroxyethyl)-4-methyl-thiazol-3-ium-3-yl]methyl]-2-methyl-pyrimidin-4-yl]formamidine CAS Name: N'-[5-[[5-(2-hydroxyethyl)-4-methyl-3-thiazol-3-iumyl]methyl]-2-methyl-4-pyrimidinyl]-N,N-bis(phenylmethyl)methanimidamide IUPAC Name: N,N-dibenzyl-N'-[5-[[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]methyl]-2-methylpyrimidin-4-yl]methanimidamide Traditional Name: N,N-dibenzyl-N'-[5-[[5-(2-hydroxyethyl)-4-methyl-thiazol-3-ium-3-yl]methyl]-2-methyl-pyrimidin-4-yl]formamidine Formula: C27H30N5OS+ MolecularWeight: 472.625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC2=CN=C(N=C2N=CN(CC3=CC=CC=C3)CC4=CC=CC=C4)C)CCO

Isomeric SMILES

CC1=C(SC=[N+]1CC2=CN=C(N=C2N=CN(CC3=CC=CC=C3)CC4=CC=CC=C4)C)CCO

InChI

InChI=1S/C27H30N5OS/c1-21-26(13-14-33)34-20-32(21)18-25-15-28-22(2)30-27(25)29-19-31(16-23-9-5-3-6-10-23)17-24-11-7-4-8-12-24/h3-12,15,19-20,33H,13-14,16-18H2,1-2H3/q+1