3-azanyl-7-chloranyl-2,1-benzothiazole-5-carbonitrile

Systemtic Name: 3-azanyl-7-chloranyl-2,1-benzothiazole-5-carbonitrile Openeye Name: 3-amino-7-chloro-2,1-benzothiazole-5-carbonitrile CAS Name: 3-amino-7-chloro-2,1-benzothiazole-5-carbonitrile IUPAC Name: 3-amino-7-chloro-2,1-benzothiazole-5-carbonitrile Traditional Name: 3-amino-7-chloro-2,1-benzothiazole-5-carbonitrile Formula: C8H4ClN3S MolecularWeight: 209.65546

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=NSC(=C21)N)Cl)C#N

Isomeric SMILES

C1=C(C=C(C2=NSC(=C21)N)Cl)C#N

InChI

InChI=1S/C8H4ClN3S/c9-6-2-4(3-10)1-5-7(6)12-13-8(5)11/h1-2H,11H2