2-[[1,3-benzodioxol-5-ylmethyl-[(4-chlorophenyl)methyl]amino]methyl]-N-cyclohexyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(4-chlorophenyl)methyl]amino]methyl]-N-cyclohexyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(4-chlorophenyl)methyl]amino]methyl]-N-cyclohexyl-thiazole-4-carboxamide CAS Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(4-chlorophenyl)methyl]amino]methyl]-N-cyclohexyl-4-thiazolecarboxamide IUPAC Name: 2-[[1,3-benzodioxol-5-ylmethyl-[(4-chlorophenyl)methyl]amino]methyl]-N-cyclohexyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(4-chlorobenzyl)-piperonyl-amino]methyl]-N-cyclohexyl-thiazole-4-carboxamide Formula: C26H28ClN3O3S MolecularWeight: 498.03682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CSC(=N2)CN(CC3=CC=C(C=C3)Cl)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CSC(=N2)CN(CC3=CC=C(C=C3)Cl)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H28ClN3O3S/c27-20-9-6-18(7-10-20)13-30(14-19-8-11-23-24(12-19)33-17-32-23)15-25-29-22(16-34-25)26(31)28-21-4-2-1-3-5-21/h6-12,16,21H,1-5,13-15,17H2,(H,28,31)