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

Systemtic Name: 3-methyl-1,2-benzothiazole-5-carbonitrile Openeye Name: 3-methyl-1,2-benzothiazole-5-carbonitrile CAS Name: 3-methyl-1,2-benzothiazole-5-carbonitrile IUPAC Name: 3-methyl-1,2-benzothiazole-5-carbonitrile Traditional Name: 3-methyl-1,2-benzothiazole-5-carbonitrile Formula: C9H6N2S MolecularWeight: 174.22234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC2=C1C=C(C=C2)C#N

Isomeric SMILES

CC1=NSC2=C1C=C(C=C2)C#N

InChI

InChI=1S/C9H6N2S/c1-6-8-4-7(5-10)2-3-9(8)12-11-6/h2-4H,1H3