N-(5-chloranyl-6-methyl-1,3-benzothiazol-2-yl)-3,5,7-trimethyl-adamantane-1-carboxamide

Systemtic Name: N-(5-chloranyl-6-methyl-1,3-benzothiazol-2-yl)-3,5,7-trimethyl-adamantane-1-carboxamide Openeye Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-3,5,7-trimethyl-adamantane-1-carboxamide CAS Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-3,5,7-trimethyl-1-adamantanecarboxamide IUPAC Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-3,5,7-trimethyladamantane-1-carboxamide Traditional Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-3,5,7-trimethyl-adamantane-1-carboxamide Formula: C22H27ClN2OS MolecularWeight: 402.98058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1Cl)N=C(S2)NC(=O)C34CC5(CC(C3)(CC(C5)(C4)C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1Cl)N=C(S2)NC(=O)C34CC5(CC(C3)(CC(C5)(C4)C)C)C

InChI

InChI=1S/C22H27ClN2OS/c1-13-5-16-15(6-14(13)23)24-18(27-16)25-17(26)22-10-19(2)7-20(3,11-22)9-21(4,8-19)12-22/h5-6H,7-12H2,1-4H3,(H,24,25,26)