1-butyl-3-[4-[(4-fluorophenyl)carbamothioylamino]phenyl]sulfonyl-urea

Systemtic Name: 1-butyl-3-[4-[(4-fluorophenyl)carbamothioylamino]phenyl]sulfonyl-urea Openeye Name: 1-butyl-3-[4-[(4-fluorophenyl)carbamothioylamino]phenyl]sulfonyl-urea CAS Name: 1-butyl-3-[4-[[(4-fluoroanilino)-sulfanylidenemethyl]amino]phenyl]sulfonylurea IUPAC Name: 1-butyl-3-[4-[(4-fluorophenyl)carbamothioylamino]phenyl]sulfonylurea Traditional Name: 1-butyl-3-[4-[(4-fluorophenyl)thiocarbamoylamino]phenyl]sulfonyl-urea Formula: C18H21FN4O3S2 MolecularWeight: 424.512743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C18H21FN4O3S2/c1-2-3-12-20-17(24)23-28(25,26)16-10-8-15(9-11-16)22-18(27)21-14-6-4-13(19)5-7-14/h4-11H,2-3,12H2,1H3,(H2,20,23,24)(H2,21,22,27)