N-[2-[2-methyl-2-[(phenylmethyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[2-methyl-2-[(phenylmethyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[2-(benzylcarbamothioyl)-2-methyl-hydrazino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[2-methyl-2-[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazinyl]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[2-(benzylcarbamothioyl)-2-methylhydrazinyl]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-[N'-(benzylthiocarbamoyl)-N'-methyl-hydrazino]-2-keto-ethyl]adamantane-1-carboxamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCC1=CC=CC=C1)NC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C(=S)NCC1=CC=CC=C1)NC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H30N4O2S/c1-26(21(29)24-13-15-5-3-2-4-6-15)25-19(27)14-23-20(28)22-10-16-7-17(11-22)9-18(8-16)12-22/h2-6,16-18H,7-14H2,1H3,(H,23,28)(H,24,29)(H,25,27)