1-heptyl-3-[[5-[2-(heptylcarbamothioyl)hydrazinyl]-5-oxidanylidene-pentanoyl]amino]thiourea

Systemtic Name: 1-heptyl-3-[[5-[2-(heptylcarbamothioyl)hydrazinyl]-5-oxidanylidene-pentanoyl]amino]thiourea Openeye Name: 1-heptyl-3-[[5-[2-(heptylcarbamothioyl)hydrazino]-5-oxo-pentanoyl]amino]thiourea CAS Name: 1-heptyl-3-[[5-[[(heptylamino)-sulfanylidenemethyl]hydrazo]-1,5-dioxopentyl]amino]thiourea IUPAC Name: 1-heptyl-3-[[5-[2-(heptylcarbamothioyl)hydrazinyl]-5-oxopentanoyl]amino]thiourea Traditional Name: 1-heptyl-3-[[5-[N'-(heptylthiocarbamoyl)hydrazino]-5-keto-pentanoyl]amino]thiourea Formula: C21H42N6O2S2 MolecularWeight: 474.72718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NNC(=O)CCCC(=O)NNC(=S)NCCCCCCC

Isomeric SMILES

CCCCCCCNC(=S)NNC(=O)CCCC(=O)NNC(=S)NCCCCCCC

InChI

InChI=1S/C21H42N6O2S2/c1-3-5-7-9-11-16-22-20(30)26-24-18(28)14-13-15-19(29)25-27-21(31)23-17-12-10-8-6-4-2/h3-17H2,1-2H3,(H,24,28)(H,25,29)(H2,22,26,30)(H2,23,27,31)