4-chloranyl-N-[2-[2-[[(2S)-2-methylheptyl]carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-chloranyl-N-[2-[2-[[(2S)-2-methylheptyl]carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-chloro-N-[2-[2-[[(2S)-2-methylheptyl]carbamothioyl]hydrazino]-2-oxo-ethyl]benzamide CAS Name: 4-chloro-N-[2-[[[[(2S)-2-methylheptyl]amino]-sulfanylidenemethyl]hydrazo]-2-oxoethyl]benzamide IUPAC Name: 4-chloro-N-[2-[2-[[(2S)-2-methylheptyl]carbamothioyl]hydrazinyl]-2-oxoethyl]benzamide Traditional Name: 4-chloro-N-[2-keto-2-[N'-[[(2S)-2-methylheptyl]thiocarbamoyl]hydrazino]ethyl]benzamide Formula: C18H27ClN4O2S MolecularWeight: 398.95058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CNC(=S)NNC(=O)CNC(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCC[C@H](C)CNC(=S)NNC(=O)CNC(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C18H27ClN4O2S/c1-3-4-5-6-13(2)11-21-18(26)23-22-16(24)12-20-17(25)14-7-9-15(19)10-8-14/h7-10,13H,3-6,11-12H2,1-2H3,(H,20,25)(H,22,24)(H2,21,23,26)/t13-/m0/s1