N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-(phenylcarbonyl)benzamide

Systemtic Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-(phenylcarbonyl)benzamide Openeye Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-benzoyl-benzamide CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-benzoylbenzamide IUPAC Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-benzoylbenzamide Traditional Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-4-benzoyl-benzamide Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)C5=CC=C(C=C5)C(=O)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)NC(=O)C5=CC=C(C=C5)C(=O)C6=CC=CC=C6

InChI

InChI=1S/C26H25N3O2S/c30-22(19-4-2-1-3-5-19)20-6-8-21(9-7-20)23(31)27-25-29-28-24(32-25)26-13-16-10-17(14-26)12-18(11-16)15-26/h1-9,16-18H,10-15H2,(H,27,29,31)