2-[1-(1,3-benzothiazol-2-yl)ethyl-methyl-amino]ethanenitrile

Systemtic Name: 2-[1-(1,3-benzothiazol-2-yl)ethyl-methyl-amino]ethanenitrile Openeye Name: 2-[1-(1,3-benzothiazol-2-yl)ethyl-methyl-amino]acetonitrile CAS Name: 2-[1-(1,3-benzothiazol-2-yl)ethyl-methylamino]acetonitrile IUPAC Name: 2-[1-(1,3-benzothiazol-2-yl)ethyl-methylamino]acetonitrile Traditional Name: 2-[1-(1,3-benzothiazol-2-yl)ethyl-methyl-amino]acetonitrile Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3S/c1-9(15(2)8-7-13)12-14-10-5-3-4-6-11(10)16-12/h3-6,9H,8H2,1-2H3