N'-(1-adamantyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)ethanediamide

Systemtic Name: N'-(1-adamantyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)ethanediamide Openeye Name: N'-(1-adamantyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)oxamide CAS Name: N'-(1-adamantyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)oxamide IUPAC Name: N'-(1-adamantyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)oxamide Traditional Name: N'-(1-adamantyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)oxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H25N3O3S/c1-2-27-15-3-4-16-17(8-15)28-20(22-16)23-18(25)19(26)24-21-9-12-5-13(10-21)7-14(6-12)11-21/h3-4,8,12-14H,2,5-7,9-11H2,1H3,(H,24,26)(H,22,23,25)