2-[[2-[(3,5-dimethyl-1-adamantyl)amino]-2-oxidanylidene-ethyl]-(2-sulfanylethyl)amino]-N-(2-sulfanylethyl)ethanamide; technetium

Systemtic Name: 2-[[2-[(3,5-dimethyl-1-adamantyl)amino]-2-oxidanylidene-ethyl]-(2-sulfanylethyl)amino]-N-(2-sulfanylethyl)ethanamide; technetium Openeye Name: 2-[[2-[(3,5-dimethyl-1-adamantyl)amino]-2-oxo-ethyl]-(2-sulfanylethyl)amino]-N-(2-sulfanylethyl)acetamide; technetium CAS Name: 2-[[2-[(3,5-dimethyl-1-adamantyl)amino]-2-oxoethyl]-(2-mercaptoethyl)amino]-N-(2-mercaptoethyl)acetamide; technetium IUPAC Name: 2-[[2-[(3,5-dimethyl-1-adamantyl)amino]-2-oxoethyl]-(2-sulfanylethyl)amino]-N-(2-sulfanylethyl)acetamide; technetium Traditional Name: 2-[[2-[(3,5-dimethyl-1-adamantyl)amino]-2-keto-ethyl]-(2-mercaptoethyl)amino]-N-(2-mercaptoethyl)acetamide; technetium Formula: C20H35N3O2S2Tc MolecularWeight: 511.548016

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)NC(=O)CN(CCS)CC(=O)NCCS)C.[Tc]

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)NC(=O)CN(CCS)CC(=O)NCCS)C.[Tc]

InChI

InChI=1S/C20H35N3O2S2.Tc/c1-18-7-15-8-19(2,12-18)14-20(9-15,13-18)22-17(25)11-23(4-6-27)10-16(24)21-3-5-26;/h15,26-27H,3-14H2,1-2H3,(H,21,24)(H,22,25);