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

Systemtic Name: 2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-bromanyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-bromo-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-7-bromo-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7-bromopyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-7-bromo-pyrido[1,2-a]pyrimidin-4-one Formula: C14H13BrN6OS MolecularWeight: 393.26162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2N)SCC3=CC(=O)N4C=C(C=CC4=N3)Br

Isomeric SMILES

C1CC1C2=NN=C(N2N)SCC3=CC(=O)N4C=C(C=CC4=N3)Br

InChI

InChI=1S/C14H13BrN6OS/c15-9-3-4-11-17-10(5-12(22)20(11)6-9)7-23-14-19-18-13(21(14)16)8-1-2-8/h3-6,8H,1-2,7,16H2