N-(1-phenyl-1-sulfanyl-propan-2-yl)adamantane-2-carboxamide

Systemtic Name: N-(1-phenyl-1-sulfanyl-propan-2-yl)adamantane-2-carboxamide Openeye Name: N-(1-methyl-2-phenyl-2-sulfanyl-ethyl)adamantane-2-carboxamide CAS Name: N-(1-mercapto-1-phenylpropan-2-yl)-2-adamantanecarboxamide IUPAC Name: N-(1-phenyl-1-sulfanylpropan-2-yl)adamantane-2-carboxamide Traditional Name: N-(2-mercapto-1-methyl-2-phenyl-ethyl)adamantane-2-carboxamide Formula: C20H27NOS MolecularWeight: 329.49948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)S)NC(=O)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CC(C(C1=CC=CC=C1)S)NC(=O)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C20H27NOS/c1-12(19(23)15-5-3-2-4-6-15)21-20(22)18-16-8-13-7-14(10-16)11-17(18)9-13/h2-6,12-14,16-19,23H,7-11H2,1H3,(H,21,22)