N-[2-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide

Systemtic Name: N-[2-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide Openeye Name: N-[2-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxo-ethyl]-N-methyl-benzamide CAS Name: N-[2-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]-N-methylbenzamide IUPAC Name: N-[2-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-oxoethyl]-N-methylbenzamide Traditional Name: N-[2-[[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]amino]-2-keto-ethyl]-N-methyl-benzamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=NN=C(S1)C23CC4CC(C2)CC(C4)C3)C(=O)C5=CC=CC=C5

Isomeric SMILES

CN(CC(=O)NC1=NN=C(S1)C23CC4CC(C2)CC(C4)C3)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C22H26N4O2S/c1-26(19(28)17-5-3-2-4-6-17)13-18(27)23-21-25-24-20(29-21)22-10-14-7-15(11-22)9-16(8-14)12-22/h2-6,14-16H,7-13H2,1H3,(H,23,25,27)