N-[[(1S)-1-(1-adamantyl)ethyl]carbamothioyl]-2-(4-methylphenoxy)ethanamide

Systemtic Name: N-[[(1S)-1-(1-adamantyl)ethyl]carbamothioyl]-2-(4-methylphenoxy)ethanamide Openeye Name: N-[[(1S)-1-(1-adamantyl)ethyl]carbamothioyl]-2-(4-methylphenoxy)acetamide CAS Name: N-[[[(1S)-1-(1-adamantyl)ethyl]amino]-sulfanylidenemethyl]-2-(4-methylphenoxy)acetamide IUPAC Name: N-[[(1S)-1-(1-adamantyl)ethyl]carbamothioyl]-2-(4-methylphenoxy)acetamide Traditional Name: N-[[(1S)-1-(1-adamantyl)ethyl]thiocarbamoyl]-2-(4-methylphenoxy)acetamide Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(=O)NC(=S)NC(C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC=C(C=C1)OCC(=O)NC(=S)N[C@@H](C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H30N2O2S/c1-14-3-5-19(6-4-14)26-13-20(25)24-21(27)23-15(2)22-10-16-7-17(11-22)9-18(8-16)12-22/h3-6,15-18H,7-13H2,1-2H3,(H2,23,24,25,27)/t15-,16?,17?,18?,22?/m0/s1