2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-N-naphthalen-1-yl-benzamide

Systemtic Name: 2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-N-naphthalen-1-yl-benzamide Openeye Name: 2-[2-(1-adamantylamino)-2-oxo-ethyl]sulfanyl-N-(1-naphthyl)benzamide CAS Name: 2-[[2-(1-adamantylamino)-2-oxoethyl]thio]-N-(1-naphthalenyl)benzamide IUPAC Name: 2-[2-(1-adamantylamino)-2-oxoethyl]sulfanyl-N-naphthalen-1-ylbenzamide Traditional Name: 2-[[2-(1-adamantylamino)-2-keto-ethyl]thio]-N-(1-naphthyl)benzamide Formula: C29H30N2O2S MolecularWeight: 470.6257

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC4=CC=CC=C4C(=O)NC5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC4=CC=CC=C4C(=O)NC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C29H30N2O2S/c32-27(31-29-15-19-12-20(16-29)14-21(13-19)17-29)18-34-26-11-4-3-9-24(26)28(33)30-25-10-5-7-22-6-1-2-8-23(22)25/h1-11,19-21H,12-18H2,(H,30,33)(H,31,32)