1-(1-adamantyl)-3-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-1-methyl-urea

Systemtic Name: 1-(1-adamantyl)-3-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-1-methyl-urea Openeye Name: 1-(1-adamantyl)-3-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)-1-methyl-urea CAS Name: 1-(1-adamantyl)-3-[4-methoxy-7-(4-morpholinyl)-1,3-benzothiazol-2-yl]-1-methylurea IUPAC Name: 1-(1-adamantyl)-3-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-1-methylurea Traditional Name: 1-(1-adamantyl)-3-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)-1-methyl-urea Formula: C24H32N4O3S MolecularWeight: 456.60088

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)NC1=NC2=C(C=CC(=C2S1)N3CCOCC3)OC)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CN(C(=O)NC1=NC2=C(C=CC(=C2S1)N3CCOCC3)OC)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C24H32N4O3S/c1-27(24-12-15-9-16(13-24)11-17(10-15)14-24)23(29)26-22-25-20-19(30-2)4-3-18(21(20)32-22)28-5-7-31-8-6-28/h3-4,15-17H,5-14H2,1-2H3,(H,25,26,29)