2-[4-methyl-2-(phenylmethyl)-1,3-thiazol-5-yl]ethanenitrile

Systemtic Name: 2-[4-methyl-2-(phenylmethyl)-1,3-thiazol-5-yl]ethanenitrile Openeye Name: 2-(2-benzyl-4-methyl-thiazol-5-yl)acetonitrile CAS Name: 2-[4-methyl-2-(phenylmethyl)-5-thiazolyl]acetonitrile IUPAC Name: 2-(2-benzyl-4-methyl-1,3-thiazol-5-yl)acetonitrile Traditional Name: 2-(2-benzyl-4-methyl-thiazol-5-yl)acetonitrile Formula: C13H12N2S MolecularWeight: 228.31278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC2=CC=CC=C2)CC#N

Isomeric SMILES

CC1=C(SC(=N1)CC2=CC=CC=C2)CC#N

InChI

InChI=1S/C13H12N2S/c1-10-12(7-8-14)16-13(15-10)9-11-5-3-2-4-6-11/h2-6H,7,9H2,1H3