2-(1-adamantyl)-N-(phenylmethyl)ethanethioamide

Systemtic Name: 2-(1-adamantyl)-N-(phenylmethyl)ethanethioamide Openeye Name: 2-(1-adamantyl)-N-benzyl-thioacetamide CAS Name: 2-(1-adamantyl)-N-(phenylmethyl)ethanethioamide IUPAC Name: 2-(1-adamantyl)-N-benzylethanethioamide Traditional Name: 2-(1-adamantyl)-N-benzyl-thioacetamide Formula: C19H25NS MolecularWeight: 299.4735

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=S)NCC4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C19H25NS/c21-18(20-13-14-4-2-1-3-5-14)12-19-9-15-6-16(10-19)8-17(7-15)11-19/h1-5,15-17H,6-13H2,(H,20,21)