N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)adamantane-1-carboxamide

Systemtic Name: N-(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)adamantane-1-carboxamide Openeye Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)adamantane-1-carboxamide CAS Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-1-adamantanecarboxamide IUPAC Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)adamantane-1-carboxamide Traditional Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)adamantane-1-carboxamide Formula: C25H32ClN3O3S MolecularWeight: 490.05788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)Cl)SC(=N2)N(CCN3CCOCC3)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=C2C(=C(C=C1)Cl)SC(=N2)N(CCN3CCOCC3)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C25H32ClN3O3S/c1-31-20-3-2-19(26)22-21(20)27-24(33-22)29(5-4-28-6-8-32-9-7-28)23(30)25-13-16-10-17(14-25)12-18(11-16)15-25/h2-3,16-18H,4-15H2,1H3