N-[4-(oxolan-2-ylmethylcarbamothioylamino)phenyl]sulfonylbenzamide

Systemtic Name: N-[4-(oxolan-2-ylmethylcarbamothioylamino)phenyl]sulfonylbenzamide Openeye Name: N-[4-(tetrahydrofuran-2-ylmethylcarbamothioylamino)phenyl]sulfonylbenzamide CAS Name: N-[4-[[(2-oxolanylmethylamino)-sulfanylidenemethyl]amino]phenyl]sulfonylbenzamide IUPAC Name: N-[4-(oxolan-2-ylmethylcarbamothioylamino)phenyl]sulfonylbenzamide Traditional Name: N-[4-(tetrahydrofurfurylthiocarbamoylamino)phenyl]sulfonylbenzamide Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC(OC1)CNC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O4S2/c23-18(14-5-2-1-3-6-14)22-28(24,25)17-10-8-15(9-11-17)21-19(27)20-13-16-7-4-12-26-16/h1-3,5-6,8-11,16H,4,7,12-13H2,(H,22,23)(H2,20,21,27)