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

Systemtic Name: 2-(1-benzothiophen-3-yl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinane Openeye Name: 2-(benzothiophen-3-yl)-1,3-bis[(4-methoxyphenyl)methyl]hexahydropyrimidine CAS Name: 2-(1-benzothiophen-3-yl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinane IUPAC Name: 2-(1-benzothiophen-3-yl)-1,3-bis[(4-methoxyphenyl)methyl]-1,3-diazinane Traditional Name: 2-(benzothiophen-3-yl)-1,3-bis(p-anisyl)hexahydropyrimidine Formula: C28H30N2O2S MolecularWeight: 458.615

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCN(C2C3=CSC4=CC=CC=C43)CC5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCN(C2C3=CSC4=CC=CC=C43)CC5=CC=C(C=C5)OC

InChI

InChI=1S/C28H30N2O2S/c1-31-23-12-8-21(9-13-23)18-29-16-5-17-30(19-22-10-14-24(32-2)15-11-22)28(29)26-20-33-27-7-4-3-6-25(26)27/h3-4,6-15,20,28H,5,16-19H2,1-2H3