4-[(3,5-dimethylphenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide

Systemtic Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Openeye Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide CAS Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)-2-thiophenecarboxamide IUPAC Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Traditional Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Formula: C22H20N2O2S2 MolecularWeight: 408.5364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=CS3)COC4=CC(=CC(=C4)C)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=CS3)COC4=CC(=CC(=C4)C)C

InChI

InChI=1S/C22H20N2O2S2/c1-13-7-14(2)9-17(8-13)26-11-16-10-19(27-12-16)21(25)24-22-23-20-15(3)5-4-6-18(20)28-22/h4-10,12H,11H2,1-3H3,(H,23,24,25)