(5-oxidanylidene-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl-triphenyl-phosphanium

Systemtic Name: (5-oxidanylidene-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl-triphenyl-phosphanium Openeye Name: (5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl-triphenyl-phosphonium CAS Name: (5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl-triphenylphosphonium IUPAC Name: (5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl-triphenylphosphanium Traditional Name: (5-keto-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl-triphenyl-phosphonium Formula: C24H19N3OPS+ MolecularWeight: 428.465921

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC(=O)N3C(=N2)SC=N3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC(=O)N3C(=N2)SC=N3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H19N3OPS/c28-23-16-19(26-24-27(23)25-18-30-24)17-29(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-16,18H,17H2/q+1