3-ethynyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]aniline

Systemtic Name: 3-ethynyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]aniline Openeye Name: 3-ethynyl-N-[(2-methylthiazol-4-yl)methyl]aniline CAS Name: 3-ethynyl-N-[(2-methyl-4-thiazolyl)methyl]aniline IUPAC Name: 3-ethynyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]aniline Traditional Name: (3-ethynylphenyl)-[(2-methylthiazol-4-yl)methyl]amine Formula: C13H12N2S MolecularWeight: 228.31278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CNC2=CC=CC(=C2)C#C

Isomeric SMILES

CC1=NC(=CS1)CNC2=CC=CC(=C2)C#C

InChI

InChI=1S/C13H12N2S/c1-3-11-5-4-6-12(7-11)14-8-13-9-16-10(2)15-13/h1,4-7,9,14H,8H2,2H3