N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]adamantane-1-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]adamantane-1-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-1-adamantanecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]adamantane-1-carboxamide Traditional Name: N-(4-methyl-5-piperonyl-thiazol-2-yl)adamantane-1-carboxamide Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C23CC4CC(C2)CC(C4)C3)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C23CC4CC(C2)CC(C4)C3)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C23H26N2O3S/c1-13-20(8-14-2-3-18-19(7-14)28-12-27-18)29-22(24-13)25-21(26)23-9-15-4-16(10-23)6-17(5-15)11-23/h2-3,7,15-17H,4-6,8-12H2,1H3,(H,24,25,26)