3-[1-(1,3-benzothiazol-2-yl)ethylamino]propanenitrile

Systemtic Name: 3-[1-(1,3-benzothiazol-2-yl)ethylamino]propanenitrile Openeye Name: 3-[1-(1,3-benzothiazol-2-yl)ethylamino]propanenitrile CAS Name: 3-[1-(1,3-benzothiazol-2-yl)ethylamino]propanenitrile IUPAC Name: 3-[1-(1,3-benzothiazol-2-yl)ethylamino]propanenitrile Traditional Name: 3-[1-(1,3-benzothiazol-2-yl)ethylamino]propionitrile Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3S/c1-9(14-8-4-7-13)12-15-10-5-2-3-6-11(10)16-12/h2-3,5-6,9,14H,4,8H2,1H3