6-azanyl-2-[2-(4-chloranylphenoxy)ethylsulfanyl]-5-phenyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[2-(4-chloranylphenoxy)ethylsulfanyl]-5-phenyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[2-(4-chlorophenoxy)ethylsulfanyl]-5-phenyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[2-(4-chlorophenoxy)ethylthio]-5-phenyl-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[2-(4-chlorophenoxy)ethylsulfanyl]-5-phenyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[2-(4-chlorophenoxy)ethylthio]-5-phenyl-1H-pyrimidin-4-one Formula: C18H16ClN3O2S MolecularWeight: 373.85654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(NC(=NC2=O)SCCOC3=CC=C(C=C3)Cl)N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(NC(=NC2=O)SCCOC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C18H16ClN3O2S/c19-13-6-8-14(9-7-13)24-10-11-25-18-21-16(20)15(17(23)22-18)12-4-2-1-3-5-12/h1-9H,10-11H2,(H3,20,21,22,23)