4-phenyl-5-propan-2-yl-1,3,4-thiadiazol-4-ium-2-thiolate

Systemtic Name: 4-phenyl-5-propan-2-yl-1,3,4-thiadiazol-4-ium-2-thiolate Openeye Name: 5-isopropyl-4-phenyl-1,3,4-thiadiazol-4-ium-2-thiolate CAS Name: 4-phenyl-5-propan-2-yl-1,3,4-thiadiazol-4-ium-2-thiolate IUPAC Name: 4-phenyl-5-propan-2-yl-1,3,4-thiadiazol-4-ium-2-thiolate Traditional Name: 5-isopropyl-4-phenyl-1,3,4-thiadiazol-4-ium-2-thiolate Formula: C11H12N2S2 MolecularWeight: 236.35638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](N=C(S1)[S-])C2=CC=CC=C2

Isomeric SMILES

CC(C)C1=[N+](N=C(S1)[S-])C2=CC=CC=C2

InChI

InChI=1S/C11H12N2S2/c1-8(2)10-13(12-11(14)15-10)9-6-4-3-5-7-9/h3-8H,1-2H3