5-[(4-butoxyphenyl)methyl]-6-chloranyl-N,N-diethyl-2-methylsulfanyl-pyrimidin-4-amine

Systemtic Name: 5-[(4-butoxyphenyl)methyl]-6-chloranyl-N,N-diethyl-2-methylsulfanyl-pyrimidin-4-amine Openeye Name: 5-[(4-butoxyphenyl)methyl]-6-chloro-N,N-diethyl-2-methylsulfanyl-pyrimidin-4-amine CAS Name: 5-[(4-butoxyphenyl)methyl]-6-chloro-N,N-diethyl-2-(methylthio)-4-pyrimidinamine IUPAC Name: 5-[(4-butoxyphenyl)methyl]-6-chloro-N,N-diethyl-2-methylsulfanylpyrimidin-4-amine Traditional Name: [5-(4-butoxybenzyl)-6-chloro-2-(methylthio)pyrimidin-4-yl]-diethyl-amine Formula: C20H28ClN3OS MolecularWeight: 393.97382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28ClN3OS/c1-5-8-13-25-16-11-9-15(10-12-16)14-17-18(21)22-20(26-4)23-19(17)24(6-2)7-3/h9-12H,5-8,13-14H2,1-4H3