N-[4-(1,3-benzodioxol-5-ylcarbonylamino)cyclohexyl]-2-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-ylcarbonylamino)cyclohexyl]-2-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[4-(1,3-benzodioxole-5-carbonylamino)cyclohexyl]-2-[(2-isopropyl-5-methyl-phenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]cyclohexyl]-2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-[4-(1,3-benzodioxole-5-carbonylamino)cyclohexyl]-2-[(5-methyl-2-propan-2-ylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[(2-isopropyl-5-methyl-phenoxy)methyl]-N-[4-(piperonyloylamino)cyclohexyl]thiazole-4-carboxamide Formula: C29H33N3O5S MolecularWeight: 535.65442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC2=NC(=CS2)C(=O)NC3CCC(CC3)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC2=NC(=CS2)C(=O)NC3CCC(CC3)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C29H33N3O5S/c1-17(2)22-10-4-18(3)12-25(22)35-14-27-32-23(15-38-27)29(34)31-21-8-6-20(7-9-21)30-28(33)19-5-11-24-26(13-19)37-16-36-24/h4-5,10-13,15,17,20-21H,6-9,14,16H2,1-3H3,(H,30,33)(H,31,34)