N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-chloranyl-N-(phenylmethyl)ethanamide

Systemtic Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-chloranyl-N-(phenylmethyl)ethanamide Openeye Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-N-benzyl-2-chloro-acetamide CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-chloro-N-(phenylmethyl)acetamide IUPAC Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-N-benzyl-2-chloroacetamide Traditional Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-N-benzyl-2-chloro-acetamide Formula: C21H24ClN3OS MolecularWeight: 401.95276

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)N(CC5=CC=CC=C5)C(=O)CCl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NN=C(S4)N(CC5=CC=CC=C5)C(=O)CCl

InChI

InChI=1S/C21H24ClN3OS/c22-12-18(26)25(13-14-4-2-1-3-5-14)20-24-23-19(27-20)21-9-15-6-16(10-21)8-17(7-15)11-21/h1-5,15-17H,6-13H2