N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-propan-2-ylphenoxy)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-propan-2-ylphenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-isopropylphenoxy)methyl]thiazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-propan-2-ylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-propan-2-ylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[(2-isopropylphenoxy)methyl]-N-piperonyl-thiazole-4-carboxamide Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC2=NC(=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)C1=CC=CC=C1OCC2=NC(=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22N2O4S/c1-14(2)16-5-3-4-6-18(16)26-11-21-24-17(12-29-21)22(25)23-10-15-7-8-19-20(9-15)28-13-27-19/h3-9,12,14H,10-11,13H2,1-2H3,(H,23,25)