N-[(2R)-3-methyl-1-oxidanylidene-1-[2-(propan-2-ylcarbamothioyl)hydrazinyl]butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[(2R)-3-methyl-1-oxidanylidene-1-[2-(propan-2-ylcarbamothioyl)hydrazinyl]butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[(1R)-1-[(isopropylcarbamothioylamino)carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[(2R)-3-methyl-1-oxo-1-[[(propan-2-ylamino)-sulfanylidenemethyl]hydrazo]butan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[(2R)-3-methyl-1-oxo-1-[2-(propan-2-ylcarbamothioyl)hydrazinyl]butan-2-yl]adamantane-1-carboxamide Traditional Name: N-[(1R)-1-[(isopropylthiocarbamoylamino)carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C20H34N4O2S MolecularWeight: 394.57456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NNC(=S)NC(C)C)NC(=O)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CC(C)[C@H](C(=O)NNC(=S)NC(C)C)NC(=O)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C20H34N4O2S/c1-11(2)16(17(25)23-24-19(27)21-12(3)4)22-18(26)20-8-13-5-14(9-20)7-15(6-13)10-20/h11-16H,5-10H2,1-4H3,(H,22,26)(H,23,25)(H2,21,24,27)/t13?,14?,15?,16-,20?/m1/s1