4,6-bis[(4-ethoxyphenyl)methylsulfanyl]pyrimidin-5-amine

Systemtic Name: 4,6-bis[(4-ethoxyphenyl)methylsulfanyl]pyrimidin-5-amine Openeye Name: 4,6-bis[(4-ethoxyphenyl)methylsulfanyl]pyrimidin-5-amine CAS Name: 4,6-bis[(4-ethoxyphenyl)methylthio]-5-pyrimidinamine IUPAC Name: 4,6-bis[(4-ethoxyphenyl)methylsulfanyl]pyrimidin-5-amine Traditional Name: [4,6-bis[(4-ethoxybenzyl)thio]pyrimidin-5-yl]amine Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CSC2=C(C(=NC=N2)SCC3=CC=C(C=C3)OCC)N

Isomeric SMILES

CCOC1=CC=C(C=C1)CSC2=C(C(=NC=N2)SCC3=CC=C(C=C3)OCC)N

InChI

InChI=1S/C22H25N3O2S2/c1-3-26-18-9-5-16(6-10-18)13-28-21-20(23)22(25-15-24-21)29-14-17-7-11-19(12-8-17)27-4-2/h5-12,15H,3-4,13-14,23H2,1-2H3