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

Systemtic Name: N-[2-[2-(3-methoxypropylcarbamothioyl)hydrazinyl]-2-oxidanylidene-ethyl]-4-phenoxy-benzamide Openeye Name: N-[2-[2-(3-methoxypropylcarbamothioyl)hydrazino]-2-oxo-ethyl]-4-phenoxy-benzamide CAS Name: N-[2-[[(3-methoxypropylamino)-sulfanylidenemethyl]hydrazo]-2-oxoethyl]-4-phenoxybenzamide IUPAC Name: N-[2-[2-(3-methoxypropylcarbamothioyl)hydrazinyl]-2-oxoethyl]-4-phenoxybenzamide Traditional Name: N-[2-keto-2-[N'-(3-methoxypropylthiocarbamoyl)hydrazino]ethyl]-4-phenoxy-benzamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O4S/c1-27-13-5-12-21-20(29)24-23-18(25)14-22-19(26)15-8-10-17(11-9-15)28-16-6-3-2-4-7-16/h2-4,6-11H,5,12-14H2,1H3,(H,22,26)(H,23,25)(H2,21,24,29)