N-[4-(butylcarbamothioylamino)phenyl]sulfonylbenzamide

Systemtic Name: N-[4-(butylcarbamothioylamino)phenyl]sulfonylbenzamide Openeye Name: N-[4-(butylcarbamothioylamino)phenyl]sulfonylbenzamide CAS Name: N-[4-[[butylamino(sulfanylidene)methyl]amino]phenyl]sulfonylbenzamide IUPAC Name: N-[4-(butylcarbamothioylamino)phenyl]sulfonylbenzamide Traditional Name: N-[4-(butylthiocarbamoylamino)phenyl]sulfonylbenzamide Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H21N3O3S2/c1-2-3-13-19-18(25)20-15-9-11-16(12-10-15)26(23,24)21-17(22)14-7-5-4-6-8-14/h4-12H,2-3,13H2,1H3,(H,21,22)(H2,19,20,25)