N-[4-oxidanylidene-4-[[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]amino]butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-oxidanylidene-4-[[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]amino]butyl]adamantane-1-carboxamide Openeye Name: N-[4-[(5-benzyl-1,3,4-thiadiazol-2-yl)amino]-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-oxo-4-[[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]amino]butyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[(5-benzyl-1,3,4-thiadiazol-2-yl)amino]-4-oxobutyl]adamantane-1-carboxamide Traditional Name: N-[4-[(5-benzyl-1,3,4-thiadiazol-2-yl)amino]-4-keto-butyl]adamantane-1-carboxamide Formula: C24H30N4O2S MolecularWeight: 438.5856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)NC4=NN=C(S4)CC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)NC4=NN=C(S4)CC5=CC=CC=C5

InChI

InChI=1S/C24H30N4O2S/c29-20(26-23-28-27-21(31-23)12-16-5-2-1-3-6-16)7-4-8-25-22(30)24-13-17-9-18(14-24)11-19(10-17)15-24/h1-3,5-6,17-19H,4,7-15H2,(H,25,30)(H,26,28,29)