6-azanyl-2-[2-(4-chloranyl-3-methyl-phenoxy)ethylsulfanyl]-5-phenyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[2-(4-chloranyl-3-methyl-phenoxy)ethylsulfanyl]-5-phenyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[2-(4-chloro-3-methyl-phenoxy)ethylsulfanyl]-5-phenyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[2-(4-chloro-3-methylphenoxy)ethylthio]-5-phenyl-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[2-(4-chloro-3-methylphenoxy)ethylsulfanyl]-5-phenyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[2-(4-chloro-3-methyl-phenoxy)ethylthio]-5-phenyl-1H-pyrimidin-4-one Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCSC2=NC(=O)C(=C(N2)N)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCSC2=NC(=O)C(=C(N2)N)C3=CC=CC=C3)Cl

InChI

InChI=1S/C19H18ClN3O2S/c1-12-11-14(7-8-15(12)20)25-9-10-26-19-22-17(21)16(18(24)23-19)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H3,21,22,23,24)