4-but-3-enyl-3-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-but-3-enyl-3-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-but-3-enyl-3-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 4-but-3-enyl-3-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-but-3-enyl-3-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-but-3-enyl-3-phenyl-1H-1,2,4-triazole-5-thione Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCN1C(=NNC1=S)C2=CC=CC=C2

Isomeric SMILES

C=CCCN1C(=NNC1=S)C2=CC=CC=C2

InChI

InChI=1S/C12H13N3S/c1-2-3-9-15-11(13-14-12(15)16)10-7-5-4-6-8-10/h2,4-8H,1,3,9H2,(H,14,16)