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

Systemtic Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-ethyl-N-(phenylmethyl)butanamide Openeye Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-N-benzyl-2-ethyl-butanamide CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-ethyl-N-(phenylmethyl)butanamide IUPAC Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-N-benzyl-2-ethylbutanamide Traditional Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-N-benzyl-2-ethyl-butyramide Formula: C25H33N3OS MolecularWeight: 423.61402

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N(CC1=CC=CC=C1)C2=NN=C(S2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC(CC)C(=O)N(CC1=CC=CC=C1)C2=NN=C(S2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H33N3OS/c1-3-21(4-2)22(29)28(16-17-8-6-5-7-9-17)24-27-26-23(30-24)25-13-18-10-19(14-25)12-20(11-18)15-25/h5-9,18-21H,3-4,10-16H2,1-2H3