7-bromanyl-2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 7-bromanyl-2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-bromo-2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-bromo-2-[[(4-pentyl-1,2,4-triazol-3-yl)thio]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-bromo-2-[(4-pentyl-1,2,4-triazol-3-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(4-amyl-1,2,4-triazol-3-yl)thio]methyl]-7-bromo-pyrido[1,2-a]pyrimidin-4-one Formula: C16H18BrN5OS MolecularWeight: 408.31602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=NN=C1SCC2=CC(=O)N3C=C(C=CC3=N2)Br

Isomeric SMILES

CCCCCN1C=NN=C1SCC2=CC(=O)N3C=C(C=CC3=N2)Br

InChI

InChI=1S/C16H18BrN5OS/c1-2-3-4-7-21-11-18-20-16(21)24-10-13-8-15(23)22-9-12(17)5-6-14(22)19-13/h5-6,8-9,11H,2-4,7,10H2,1H3