N-(1-adamantyl)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-cyanoethyl)ethanamide

Systemtic Name: N-(1-adamantyl)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-cyanoethyl)ethanamide Openeye Name: N-(1-adamantyl)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-cyanoethyl)acetamide CAS Name: N-(1-adamantyl)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-cyanoethyl)acetamide IUPAC Name: N-(1-adamantyl)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-cyanoethyl)acetamide Traditional Name: N-(1-adamantyl)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(2-cyanoethyl)acetamide Formula: C24H30N4OS MolecularWeight: 422.5862

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)CC(=O)N(CCC#N)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)CC(=O)N(CCC#N)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H30N4OS/c1-27(15-22-26-20-5-2-3-6-21(20)30-22)16-23(29)28(8-4-7-25)24-12-17-9-18(13-24)11-19(10-17)14-24/h2-3,5-6,17-19H,4,8-16H2,1H3