3,5-dimethyl-4-[3-(2-methyl-1,3-thiazol-5-yl)propoxy]benzenecarbonitrile

Systemtic Name: 3,5-dimethyl-4-[3-(2-methyl-1,3-thiazol-5-yl)propoxy]benzenecarbonitrile Openeye Name: 3,5-dimethyl-4-[3-(2-methylthiazol-5-yl)propoxy]benzonitrile CAS Name: 3,5-dimethyl-4-[3-(2-methyl-5-thiazolyl)propoxy]benzonitrile IUPAC Name: 3,5-dimethyl-4-[3-(2-methyl-1,3-thiazol-5-yl)propoxy]benzonitrile Traditional Name: 3,5-dimethyl-4-[3-(2-methylthiazol-5-yl)propoxy]benzonitrile Formula: C16H18N2OS MolecularWeight: 286.39192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCC2=CN=C(S2)C)C)C#N

Isomeric SMILES

CC1=CC(=CC(=C1OCCCC2=CN=C(S2)C)C)C#N

InChI

InChI=1S/C16H18N2OS/c1-11-7-14(9-17)8-12(2)16(11)19-6-4-5-15-10-18-13(3)20-15/h7-8,10H,4-6H2,1-3H3