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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloranyl-3-methyl-phenoxy)methyl]-4-methyl-1,3-thiazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloro-3-methyl-phenoxy)methyl]-4-methyl-thiazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-5-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: 2-[(4-chloro-3-methyl-phenoxy)methyl]-4-methyl-N-piperonyl-thiazole-5-carboxamide Formula: C21H19ClN2O4S MolecularWeight: 430.90456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC(=C(S2)C(=O)NCC3=CC4=C(C=C3)OCO4)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC(=C(S2)C(=O)NCC3=CC4=C(C=C3)OCO4)C)Cl

InChI

InChI=1S/C21H19ClN2O4S/c1-12-7-15(4-5-16(12)22)26-10-19-24-13(2)20(29-19)21(25)23-9-14-3-6-17-18(8-14)28-11-27-17/h3-8H,9-11H2,1-2H3,(H,23,25)