S-phenyl adamantane-1-carbothioate

Systemtic Name: S-phenyl adamantane-1-carbothioate Openeye Name: S-phenyl adamantane-1-carbothioate CAS Name: 1-adamantanecarbothioic acid S-phenyl ester IUPAC Name: S-phenyl adamantane-1-carbothioate Traditional Name: adamantane-1-carbothioic acid S-phenyl ester Formula: C17H20OS MolecularWeight: 272.4051

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)SC4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)SC4=CC=CC=C4

InChI

InChI=1S/C17H20OS/c18-16(19-15-4-2-1-3-5-15)17-9-12-6-13(10-17)8-14(7-12)11-17/h1-5,12-14H,6-11H2