7-bromanyl-2-[(2,5-dimethylphenyl)methylsulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 7-bromanyl-2-[(2,5-dimethylphenyl)methylsulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-bromo-2-[(2,5-dimethylphenyl)methylsulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-bromo-2-[[(2,5-dimethylphenyl)methylthio]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-bromo-2-[(2,5-dimethylphenyl)methylsulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-bromo-2-[[(2,5-dimethylbenzyl)thio]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C18H17BrN2OS MolecularWeight: 389.30938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSCC2=CC(=O)N3C=C(C=CC3=N2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSCC2=CC(=O)N3C=C(C=CC3=N2)Br

InChI

InChI=1S/C18H17BrN2OS/c1-12-3-4-13(2)14(7-12)10-23-11-16-8-18(22)21-9-15(19)5-6-17(21)20-16/h3-9H,10-11H2,1-2H3