S-methyl N-[(3R,5S)-3,5-dimethyl-1-adamantyl]carbamothioate

Systemtic Name: S-methyl N-[(3R,5S)-3,5-dimethyl-1-adamantyl]carbamothioate Openeye Name: S-methyl N-[(3R,5S)-3,5-dimethyl-1-adamantyl]carbamothioate CAS Name: N-[(3R,5S)-3,5-dimethyl-1-adamantyl]carbamothioic acid S-methyl ester IUPAC Name: S-methyl N-[(3R,5S)-3,5-dimethyl-1-adamantyl]carbamothioate Traditional Name: N-[(3R,5S)-3,5-dimethyl-1-adamantyl]thiocarbamic acid S-methyl ester Formula: C14H23NOS MolecularWeight: 253.40352

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)NC(=O)SC)C

Isomeric SMILES

C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)NC(=O)SC)C

InChI

InChI=1S/C14H23NOS/c1-12-4-10-5-13(2,7-12)9-14(6-10,8-12)15-11(16)17-3/h10H,4-9H2,1-3H3,(H,15,16)/t10?,12-,13+,14?