4-oxidanylidene-4-[2-(2-phenoxyethanoylcarbamothioyl)hydrazinyl]-N-(phenylmethyl)butanamide

Systemtic Name: 4-oxidanylidene-4-[2-(2-phenoxyethanoylcarbamothioyl)hydrazinyl]-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-oxo-4-[2-[(2-phenoxyacetyl)carbamothioyl]hydrazino]butanamide CAS Name: 4-oxo-4-[[[(1-oxo-2-phenoxyethyl)amino]-sulfanylidenemethyl]hydrazo]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-oxo-4-[2-[(2-phenoxyacetyl)carbamothioyl]hydrazinyl]butanamide Traditional Name: N-benzyl-4-keto-4-[N'-[(2-phenoxyacetyl)thiocarbamoyl]hydrazino]butyramide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCC(=O)NNC(=S)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCC(=O)NNC(=S)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C20H22N4O4S/c25-17(21-13-15-7-3-1-4-8-15)11-12-18(26)23-24-20(29)22-19(27)14-28-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,21,25)(H,23,26)(H2,22,24,27,29)