4-[(3-methyl-4-propan-2-yl-phenoxy)methyl]-2,1,3-benzothiadiazole

Systemtic Name: 4-[(3-methyl-4-propan-2-yl-phenoxy)methyl]-2,1,3-benzothiadiazole Openeye Name: 4-[(4-isopropyl-3-methyl-phenoxy)methyl]-2,1,3-benzothiadiazole CAS Name: 4-[(3-methyl-4-propan-2-ylphenoxy)methyl]-2,1,3-benzothiadiazole IUPAC Name: 4-[(3-methyl-4-propan-2-ylphenoxy)methyl]-2,1,3-benzothiadiazole Traditional Name: 4-[(4-isopropyl-3-methyl-phenoxy)methyl]piazthiole Formula: C17H18N2OS MolecularWeight: 298.40262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=CC=CC3=NSN=C32)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=CC=CC3=NSN=C32)C(C)C

InChI

InChI=1S/C17H18N2OS/c1-11(2)15-8-7-14(9-12(15)3)20-10-13-5-4-6-16-17(13)19-21-18-16/h4-9,11H,10H2,1-3H3