3-butyl-4-phenyl-1,2,5-thiadiazole

Systemtic Name: 3-butyl-4-phenyl-1,2,5-thiadiazole Openeye Name: 3-butyl-4-phenyl-1,2,5-thiadiazole CAS Name: 3-butyl-4-phenyl-1,2,5-thiadiazole IUPAC Name: 3-butyl-4-phenyl-1,2,5-thiadiazole Traditional Name: 3-butyl-4-phenyl-1,2,5-thiadiazole Formula: C12H14N2S MolecularWeight: 218.31796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NSN=C1C2=CC=CC=C2

Isomeric SMILES

CCCCC1=NSN=C1C2=CC=CC=C2

InChI

InChI=1S/C12H14N2S/c1-2-3-9-11-12(14-15-13-11)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3