N'-[4-(1-adamantyl)-1,3-thiazol-2-yl]-N-(1,3-benzodioxol-5-ylmethyl)ethanediamide

Systemtic Name: N'-[4-(1-adamantyl)-1,3-thiazol-2-yl]-N-(1,3-benzodioxol-5-ylmethyl)ethanediamide Openeye Name: N'-[4-(1-adamantyl)thiazol-2-yl]-N-(1,3-benzodioxol-5-ylmethyl)oxamide CAS Name: N'-[4-(1-adamantyl)-2-thiazolyl]-N-(1,3-benzodioxol-5-ylmethyl)oxamide IUPAC Name: N'-[4-(1-adamantyl)-1,3-thiazol-2-yl]-N-(1,3-benzodioxol-5-ylmethyl)oxamide Traditional Name: N'-[4-(1-adamantyl)thiazol-2-yl]-N-piperonyl-oxamide Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)C(=O)NCC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)C(=O)NCC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C23H25N3O4S/c27-20(24-10-13-1-2-17-18(6-13)30-12-29-17)21(28)26-22-25-19(11-31-22)23-7-14-3-15(8-23)5-16(4-14)9-23/h1-2,6,11,14-16H,3-5,7-10,12H2,(H,24,27)(H,25,26,28)