4-[(3,5-dimethylphenoxy)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide

Systemtic Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Openeye Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide CAS Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-thiophenecarboxamide IUPAC Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Traditional Name: 4-[(3,5-dimethylphenoxy)methyl]-N-(6-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=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CS3)COC4=CC(=CC(=C4)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CS3)COC4=CC(=CC(=C4)C)C

InChI

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