N-[2-(1-adamantylcarbonylamino)-1,3-benzothiazol-6-yl]adamantane-1-carboxamide

Systemtic Name: N-[2-(1-adamantylcarbonylamino)-1,3-benzothiazol-6-yl]adamantane-1-carboxamide Openeye Name: N-[2-(adamantane-1-carbonylamino)-1,3-benzothiazol-6-yl]adamantane-1-carboxamide CAS Name: N-[2-[[1-adamantyl(oxo)methyl]amino]-1,3-benzothiazol-6-yl]-1-adamantanecarboxamide IUPAC Name: N-[2-(adamantane-1-carbonylamino)-1,3-benzothiazol-6-yl]adamantane-1-carboxamide Traditional Name: N-[2-(adamantane-1-carbonylamino)-1,3-benzothiazol-6-yl]adamantane-1-carboxamide Formula: C29H35N3O2S MolecularWeight: 489.6721

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC5=C(C=C4)N=C(S5)NC(=O)C67CC8CC(C6)CC(C8)C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC5=C(C=C4)N=C(S5)NC(=O)C67CC8CC(C6)CC(C8)C7

InChI

InChI=1S/C29H35N3O2S/c33-25(28-10-16-3-17(11-28)5-18(4-16)12-28)30-22-1-2-23-24(9-22)35-27(31-23)32-26(34)29-13-19-6-20(14-29)8-21(7-19)15-29/h1-2,9,16-21H,3-8,10-15H2,(H,30,33)(H,31,32,34)