2-(1-adamantyl)-N-(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(1-adamantyl)-N-(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(1-adamantyl)-N-(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(1-adamantyl)-N-(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(1-adamantyl)-N-(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(1-adamantyl)-N-(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)SC(=N2)NC(=O)CC34CC5CC(C3)CC(C5)C4)Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)SC(=N2)NC(=O)CC34CC5CC(C3)CC(C5)C4)Cl

InChI

InChI=1S/C20H23ClN2O2S/c1-25-16-6-17-15(5-14(16)21)22-19(26-17)23-18(24)10-20-7-11-2-12(8-20)4-13(3-11)9-20/h5-6,11-13H,2-4,7-10H2,1H3,(H,22,23,24)