2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(1-thiophen-2-ylethyl)benzamide

Systemtic Name: 2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(1-thiophen-2-ylethyl)benzamide Openeye Name: 2-[2-(1-adamantylamino)-2-oxo-ethyl]sulfanyl-N-[1-(2-thienyl)ethyl]benzamide CAS Name: 2-[[2-(1-adamantylamino)-2-oxoethyl]thio]-N-(1-thiophen-2-ylethyl)benzamide IUPAC Name: 2-[2-(1-adamantylamino)-2-oxoethyl]sulfanyl-N-(1-thiophen-2-ylethyl)benzamide Traditional Name: 2-[[2-(1-adamantylamino)-2-keto-ethyl]thio]-N-[1-(2-thienyl)ethyl]benzamide Formula: C25H30N2O2S2 MolecularWeight: 454.6479

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)C2=CC=CC=C2SCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C1=CC=CS1)NC(=O)C2=CC=CC=C2SCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H30N2O2S2/c1-16(21-7-4-8-30-21)26-24(29)20-5-2-3-6-22(20)31-15-23(28)27-25-12-17-9-18(13-25)11-19(10-17)14-25/h2-8,16-19H,9-15H2,1H3,(H,26,29)(H,27,28)