1,3-bis[(4-methoxyphenyl)methyl]-2-thiophen-2-yl-1,3-diazinane-1,3-diium

Systemtic Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-thiophen-2-yl-1,3-diazinane-1,3-diium Openeye Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-(2-thienyl)hexahydropyrimidine-1,3-diium CAS Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-thiophen-2-yl-1,3-diazinane-1,3-diium IUPAC Name: 1,3-bis[(4-methoxyphenyl)methyl]-2-thiophen-2-yl-1,3-diazinane-1,3-diium Traditional Name: 1,3-bis(p-anisyl)-2-(2-thienyl)hexahydropyrimidine-1,3-diium Formula: C24H30N2O2S+2 MolecularWeight: 410.5722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCC[NH+](C2C3=CC=CS3)CC4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCC[NH+](C2C3=CC=CS3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C24H28N2O2S/c1-27-21-10-6-19(7-11-21)17-25-14-4-15-26(24(25)23-5-3-16-29-23)18-20-8-12-22(28-2)13-9-20/h3,5-13,16,24H,4,14-15,17-18H2,1-2H3/p+2