N-(cyclohexylcarbamothioylimino)-4-[2-[1-(2-hydroxyethyl)-3,5-dimethyl-pyrazol-4-yl]hydrazinyl]benzamide

Systemtic Name: N-(cyclohexylcarbamothioylimino)-4-[2-[1-(2-hydroxyethyl)-3,5-dimethyl-pyrazol-4-yl]hydrazinyl]benzamide Openeye Name: N-(cyclohexylcarbamothioylimino)-4-[2-[1-(2-hydroxyethyl)-3,5-dimethyl-pyrazol-4-yl]hydrazino]benzamide CAS Name: N-[(cyclohexylamino)-sulfanylidenemethyl]imino-4-[[1-(2-hydroxyethyl)-3,5-dimethyl-4-pyrazolyl]hydrazo]benzamide IUPAC Name: N-(cyclohexylcarbamothioylimino)-4-[2-[1-(2-hydroxyethyl)-3,5-dimethylpyrazol-4-yl]hydrazinyl]benzamide Traditional Name: N-(cyclohexylthiocarbamoylimino)-4-[N'-[1-(2-hydroxyethyl)-3,5-dimethyl-pyrazol-4-yl]hydrazino]benzamide Formula: C21H29N7O2S MolecularWeight: 443.56566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCO)C)NNC2=CC=C(C=C2)C(=O)N=NC(=S)NC3CCCCC3

Isomeric SMILES

CC1=C(C(=NN1CCO)C)NNC2=CC=C(C=C2)C(=O)N=NC(=S)NC3CCCCC3

InChI

InChI=1S/C21H29N7O2S/c1-14-19(15(2)28(27-14)12-13-29)24-23-18-10-8-16(9-11-18)20(30)25-26-21(31)22-17-6-4-3-5-7-17/h8-11,17,23-24,29H,3-7,12-13H2,1-2H3,(H,22,31)