4-[5-[(4-butoxyphenyl)methyl]-6-chloranyl-2-methylsulfanyl-pyrimidin-4-yl]morpholine

Systemtic Name: 4-[5-[(4-butoxyphenyl)methyl]-6-chloranyl-2-methylsulfanyl-pyrimidin-4-yl]morpholine Openeye Name: 4-[5-[(4-butoxyphenyl)methyl]-6-chloro-2-methylsulfanyl-pyrimidin-4-yl]morpholine CAS Name: 4-[5-[(4-butoxyphenyl)methyl]-6-chloro-2-(methylthio)-4-pyrimidinyl]morpholine IUPAC Name: 4-[5-[(4-butoxyphenyl)methyl]-6-chloro-2-methylsulfanylpyrimidin-4-yl]morpholine Traditional Name: 4-[5-(4-butoxybenzyl)-6-chloro-2-(methylthio)pyrimidin-4-yl]morpholine Formula: C20H26ClN3O2S MolecularWeight: 407.95734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)N3CCOCC3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)N3CCOCC3

InChI

InChI=1S/C20H26ClN3O2S/c1-3-4-11-26-16-7-5-15(6-8-16)14-17-18(21)22-20(27-2)23-19(17)24-9-12-25-13-10-24/h5-8H,3-4,9-14H2,1-2H3