5-[(4-butoxyphenyl)methyl]-4-chloranyl-6-ethoxy-2-methylsulfanyl-pyrimidine

Systemtic Name: 5-[(4-butoxyphenyl)methyl]-4-chloranyl-6-ethoxy-2-methylsulfanyl-pyrimidine Openeye Name: 5-[(4-butoxyphenyl)methyl]-4-chloro-6-ethoxy-2-methylsulfanyl-pyrimidine CAS Name: 5-[(4-butoxyphenyl)methyl]-4-chloro-6-ethoxy-2-(methylthio)pyrimidine IUPAC Name: 5-[(4-butoxyphenyl)methyl]-4-chloro-6-ethoxy-2-methylsulfanylpyrimidine Traditional Name: 5-(4-butoxybenzyl)-4-chloro-6-ethoxy-2-(methylthio)pyrimidine Formula: C18H23ClN2O2S MolecularWeight: 366.90542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)OCC

InChI

InChI=1S/C18H23ClN2O2S/c1-4-6-11-23-14-9-7-13(8-10-14)12-15-16(19)20-18(24-3)21-17(15)22-5-2/h7-10H,4-6,11-12H2,1-3H3