N-(2-adamantyl)-2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(2-adamantyl)-2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(2-adamantyl)-2-[2-(4-methoxyanilino)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(2-adamantyl)-2-[[2-(4-methoxyanilino)-2-oxoethyl]thio]acetamide IUPAC Name: N-(2-adamantyl)-2-[2-(4-methoxyanilino)-2-oxoethyl]sulfanylacetamide Traditional Name: N-(2-adamantyl)-2-[[2-keto-2-(p-anisidino)ethyl]thio]acetamide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2C3CC4CC(C3)CC2C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C21H28N2O3S/c1-26-18-4-2-17(3-5-18)22-19(24)11-27-12-20(25)23-21-15-7-13-6-14(9-15)10-16(21)8-13/h2-5,13-16,21H,6-12H2,1H3,(H,22,24)(H,23,25)