N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-2-(3-methoxy-4-methyl-phenyl)ethanamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-2-(3-methoxy-4-methyl-phenyl)ethanamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-2-(3-methoxy-4-methyl-phenyl)acetamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-2-(3-methoxy-4-methylphenyl)acetamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-2-(3-methoxy-4-methylphenyl)acetamide Traditional Name: 2-(3-methoxy-4-methyl-phenyl)-N-(4-methyl-5-piperonyl-thiazol-2-yl)acetamide Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC(=O)NC2=NC(=C(S2)CC3=CC4=C(C=C3)OCO4)C)OC

Isomeric SMILES

CC1=C(C=C(C=C1)CC(=O)NC2=NC(=C(S2)CC3=CC4=C(C=C3)OCO4)C)OC

InChI

InChI=1S/C22H22N2O4S/c1-13-4-5-16(8-18(13)26-3)11-21(25)24-22-23-14(2)20(29-22)10-15-6-7-17-19(9-15)28-12-27-17/h4-9H,10-12H2,1-3H3,(H,23,24,25)