N-(3-ethynylphenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(3-ethynylphenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Openeye Name: N-(3-ethynylphenyl)-4-[(4-methylthiazol-2-yl)sulfanylmethyl]benzamide CAS Name: N-(3-ethynylphenyl)-4-[[(4-methyl-2-thiazolyl)thio]methyl]benzamide IUPAC Name: N-(3-ethynylphenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(3-ethynylphenyl)-4-[[(4-methylthiazol-2-yl)thio]methyl]benzamide Formula: C20H16N2OS2 MolecularWeight: 364.48384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C#C

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C20H16N2OS2/c1-3-15-5-4-6-18(11-15)22-19(23)17-9-7-16(8-10-17)13-25-20-21-14(2)12-24-20/h1,4-12H,13H2,2H3,(H,22,23)