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

Systemtic Name: 2-azanyl-1,3-benzothiazole-5-carbonitrile Openeye Name: 2-amino-1,3-benzothiazole-5-carbonitrile CAS Name: 2-amino-1,3-benzothiazole-5-carbonitrile IUPAC Name: 2-amino-1,3-benzothiazole-5-carbonitrile Traditional Name: 2-amino-1,3-benzothiazole-5-carbonitrile Formula: C8H5N3S MolecularWeight: 175.2104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C#N)N=C(S2)N

Isomeric SMILES

C1=CC2=C(C=C1C#N)N=C(S2)N

InChI

InChI=1S/C8H5N3S/c9-4-5-1-2-7-6(3-5)11-8(10)12-7/h1-3H,(H2,10,11)