3-bromanyl-5-prop-2-ynyl-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-bromanyl-5-prop-2-ynyl-1,2-thiazole-4-carbonitrile Openeye Name: 3-bromo-5-prop-2-ynyl-isothiazole-4-carbonitrile CAS Name: 3-bromo-5-prop-2-ynyl-4-isothiazolecarbonitrile IUPAC Name: 3-bromo-5-prop-2-ynyl-1,2-thiazole-4-carbonitrile Traditional Name: 3-bromo-5-propargyl-isothiazole-4-carbonitrile Formula: C7H3BrN2S MolecularWeight: 227.08112

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC1=C(C(=NS1)Br)C#N

Isomeric SMILES

C#CCC1=C(C(=NS1)Br)C#N

InChI

InChI=1S/C7H3BrN2S/c1-2-3-6-5(4-9)7(8)10-11-6/h1H,3H2