2-[(E)-3-methylbut-1-enyl]-1,3-benzothiazole

Systemtic Name: 2-[(E)-3-methylbut-1-enyl]-1,3-benzothiazole Openeye Name: 2-[(E)-3-methylbut-1-enyl]-1,3-benzothiazole CAS Name: 2-[(E)-3-methylbut-1-enyl]-1,3-benzothiazole IUPAC Name: 2-[(E)-3-methylbut-1-enyl]-1,3-benzothiazole Traditional Name: 2-[(E)-3-methylbut-1-enyl]-1,3-benzothiazole Formula: C12H13NS MolecularWeight: 203.30332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=CC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)/C=C/C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C12H13NS/c1-9(2)7-8-12-13-10-5-3-4-6-11(10)14-12/h3-9H,1-2H3/b8-7+