(5-chloranyl-4-cyano-2-propan-2-yl-1H-pyrrol-3-yl) thiocyanate

Systemtic Name: (5-chloranyl-4-cyano-2-propan-2-yl-1H-pyrrol-3-yl) thiocyanate Openeye Name: (5-chloro-4-cyano-2-isopropyl-1H-pyrrol-3-yl) thiocyanate CAS Name: thiocyanic acid (5-chloro-4-cyano-2-propan-2-yl-1H-pyrrol-3-yl) ester IUPAC Name: (5-chloro-4-cyano-2-propan-2-yl-1H-pyrrol-3-yl) thiocyanate Traditional Name: thiocyanic acid (5-chloro-4-cyano-2-isopropyl-1H-pyrrol-3-yl) ester Formula: C9H8ClN3S MolecularWeight: 225.69792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(N1)Cl)C#N)SC#N

Isomeric SMILES

CC(C)C1=C(C(=C(N1)Cl)C#N)SC#N

InChI

InChI=1S/C9H8ClN3S/c1-5(2)7-8(14-4-12)6(3-11)9(10)13-7/h5,13H,1-2H3