N-[(3,4-dimethoxyphenyl)methyl]-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]-1-(oxolan-2-yl)methanamine

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]-1-(oxolan-2-yl)methanamine Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]-1-tetrahydrofuran-2-yl-methanamine CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-N-[[2-(methylthio)-5-pyrimidinyl]methyl]-1-(2-oxolanyl)methanamine IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]-1-(oxolan-2-yl)methanamine Traditional Name: [2-(methylthio)pyrimidin-5-yl]methyl-(tetrahydrofurfuryl)-veratryl-amine Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC2CCCO2)CC3=CN=C(N=C3)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC2CCCO2)CC3=CN=C(N=C3)SC)OC

InChI

InChI=1S/C20H27N3O3S/c1-24-18-7-6-15(9-19(18)25-2)12-23(14-17-5-4-8-26-17)13-16-10-21-20(27-3)22-11-16/h6-7,9-11,17H,4-5,8,12-14H2,1-3H3