N-(1-adamantyl)-3-[3-(1-adamantylamino)-3-oxidanylidene-propyl]sulfanyl-propanamide

Systemtic Name: N-(1-adamantyl)-3-[3-(1-adamantylamino)-3-oxidanylidene-propyl]sulfanyl-propanamide Openeye Name: N-(1-adamantyl)-3-[3-(1-adamantylamino)-3-oxo-propyl]sulfanyl-propanamide CAS Name: N-(1-adamantyl)-3-[[3-(1-adamantylamino)-3-oxopropyl]thio]propanamide IUPAC Name: N-(1-adamantyl)-3-[3-(1-adamantylamino)-3-oxopropyl]sulfanylpropanamide Traditional Name: N-(1-adamantyl)-3-[[3-(1-adamantylamino)-3-keto-propyl]thio]propionamide Formula: C26H40N2O2S MolecularWeight: 444.673

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CCSCCC(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CCSCCC(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H40N2O2S/c29-23(27-25-11-17-5-18(12-25)7-19(6-17)13-25)1-3-31-4-2-24(30)28-26-14-20-8-21(15-26)10-22(9-20)16-26/h17-22H,1-16H2,(H,27,29)(H,28,30)