N-(1-adamantylcarbamothioyl)-2-[(1S,3S)-3-ethyl-2,2-dimethyl-cyclobutyl]ethanamide

Systemtic Name: N-(1-adamantylcarbamothioyl)-2-[(1S,3S)-3-ethyl-2,2-dimethyl-cyclobutyl]ethanamide Openeye Name: N-(1-adamantylcarbamothioyl)-2-[(1S,3S)-3-ethyl-2,2-dimethyl-cyclobutyl]acetamide CAS Name: N-[(1-adamantylamino)-sulfanylidenemethyl]-2-[(1S,3S)-3-ethyl-2,2-dimethylcyclobutyl]acetamide IUPAC Name: N-(1-adamantylcarbamothioyl)-2-[(1S,3S)-3-ethyl-2,2-dimethylcyclobutyl]acetamide Traditional Name: N-(1-adamantylthiocarbamoyl)-2-[(1S,3S)-3-ethyl-2,2-dimethyl-cyclobutyl]acetamide Formula: C21H34N2OS MolecularWeight: 362.57246

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(C1(C)C)CC(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC[C@H]1C[C@H](C1(C)C)CC(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H34N2OS/c1-4-16-8-17(20(16,2)3)9-18(24)22-19(25)23-21-10-13-5-14(11-21)7-15(6-13)12-21/h13-17H,4-12H2,1-3H3,(H2,22,23,24,25)/t13?,14?,15?,16-,17-,21?/m0/s1