N-(1-adamantyl)-2-[[5-[(4-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[[5-[(4-methoxyphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(1-adamantyl)-2-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: N-(1-adamantyl)-2-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: N-(1-adamantyl)-2-[[5-(p-anisidino)-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C21H26N4O2S2 MolecularWeight: 430.58674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H26N4O2S2/c1-27-17-4-2-16(3-5-17)22-19-24-25-20(29-19)28-12-18(26)23-21-9-13-6-14(10-21)8-15(7-13)11-21/h2-5,13-15H,6-12H2,1H3,(H,22,24)(H,23,26)