7-bromanyl-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 7-bromanyl-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-bromo-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-bromo-2-[[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-bromo-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-bromo-2-[[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C17H13BrN6OS MolecularWeight: 429.29372

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC(=O)N3C=C(C=CC3=N2)Br)C4=CC=NC=C4

Isomeric SMILES

CN1C(=NN=C1SCC2=CC(=O)N3C=C(C=CC3=N2)Br)C4=CC=NC=C4

InChI

InChI=1S/C17H13BrN6OS/c1-23-16(11-4-6-19-7-5-11)21-22-17(23)26-10-13-8-15(25)24-9-12(18)2-3-14(24)20-13/h2-9H,10H2,1H3