2-(1,3-benzothiazol-2-yl)-3-methyl-but-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-3-methyl-but-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-3-methyl-but-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-3-methyl-2-butenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-3-methylbut-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-3-methyl-but-2-enenitrile Formula: C12H10N2S MolecularWeight: 214.2862

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C1=NC2=CC=CC=C2S1)C

Isomeric SMILES

CC(=C(C#N)C1=NC2=CC=CC=C2S1)C

InChI

InChI=1S/C12H10N2S/c1-8(2)9(7-13)12-14-10-5-3-4-6-11(10)15-12/h3-6H,1-2H3