N-(2-adamantyl)-2-[(9S)-2-chloranyl-9H-thioxanthen-9-yl]ethanamide

Systemtic Name: N-(2-adamantyl)-2-[(9S)-2-chloranyl-9H-thioxanthen-9-yl]ethanamide Openeye Name: N-(2-adamantyl)-2-[(9S)-2-chloro-9H-thioxanthen-9-yl]acetamide CAS Name: N-(2-adamantyl)-2-[(9S)-2-chloro-9H-thioxanthen-9-yl]acetamide IUPAC Name: N-(2-adamantyl)-2-[(9S)-2-chloro-9H-thioxanthen-9-yl]acetamide Traditional Name: N-(2-adamantyl)-2-[(9S)-2-chloro-9H-thioxanthen-9-yl]acetamide Formula: C25H26ClNOS MolecularWeight: 423.99804

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)CC4C5=CC=CC=C5SC6=C4C=C(C=C6)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C[C@H]4C5=CC=CC=C5SC6=C4C=C(C=C6)Cl

InChI

InChI=1S/C25H26ClNOS/c26-18-5-6-23-21(12-18)20(19-3-1-2-4-22(19)29-23)13-24(28)27-25-16-8-14-7-15(10-16)11-17(25)9-14/h1-6,12,14-17,20,25H,7-11,13H2,(H,27,28)/t14?,15?,16?,17?,20-,25?/m0/s1