N-[2-[2-(3-methylbutylcarbamothioyl)hydrazinyl]-2-oxidanylidene-ethyl]-4-phenoxy-benzamide

Systemtic Name: N-[2-[2-(3-methylbutylcarbamothioyl)hydrazinyl]-2-oxidanylidene-ethyl]-4-phenoxy-benzamide Openeye Name: N-[2-[2-(isopentylcarbamothioyl)hydrazino]-2-oxo-ethyl]-4-phenoxy-benzamide CAS Name: N-[2-[[(3-methylbutylamino)-sulfanylidenemethyl]hydrazo]-2-oxoethyl]-4-phenoxybenzamide IUPAC Name: N-[2-[2-(3-methylbutylcarbamothioyl)hydrazinyl]-2-oxoethyl]-4-phenoxybenzamide Traditional Name: N-[2-[N'-(isoamylthiocarbamoyl)hydrazino]-2-keto-ethyl]-4-phenoxy-benzamide Formula: C21H26N4O3S MolecularWeight: 414.52114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)CNC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)CNC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C21H26N4O3S/c1-15(2)12-13-22-21(29)25-24-19(26)14-23-20(27)16-8-10-18(11-9-16)28-17-6-4-3-5-7-17/h3-11,15H,12-14H2,1-2H3,(H,23,27)(H,24,26)(H2,22,25,29)