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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloranyl-3-methyl-phenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloro-3-methyl-phenoxy)methyl]thiazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloro-3-methylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloro-3-methylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[(4-chloro-3-methyl-phenoxy)methyl]-N-piperonyl-thiazole-4-carboxamide Formula: C20H17ClN2O4S MolecularWeight: 416.87798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC(=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC(=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4)Cl

InChI

InChI=1S/C20H17ClN2O4S/c1-12-6-14(3-4-15(12)21)25-9-19-23-16(10-28-19)20(24)22-8-13-2-5-17-18(7-13)27-11-26-17/h2-7,10H,8-9,11H2,1H3,(H,22,24)