(1Z)-1-(benzenesulfonyl)-N-[2-(2,2,2-trifluoroethoxy)-5-(trifluoromethyl)anilino]methanimidoyl cyanide

Formula:C17H11N3O3F6S Mutagenic:none Tumorigenic:none Reproductive Effective:none (1Z)-1-(benzenesulfonyl)-N-[2-(2,2,2-trifluoroethoxy)-5-(trifluoromethyl)anilino]methanimidoyl cyanide is a drug-like molecule.

MolName	(1Z)-1-(benzenesulfonyl)-N-[2-(2,2,2-trifluoroethoxy)-5-(trifluoromethyl)anilino]methanimidoyl cyanide
MolecularFormula	C17H11N3O3F6S
Smiles	N#C/C(/S(c1ccccc1)(=O)=O)=N/Nc(cc(C(F)(F)F)cc1)c1OCC(F)(F)F
InChI	InChI=1S/C17H11F6N3O3S/c18-16(19,20)10-29-14-7-6-11(17(21,22)23)8-13(14)25-26-15(9-24)30(27,28)12-4-2-1-3-5-12/h1-8,25H,10H2
InChIK	QSZOKZGIXLTEGX-UHFFFAOYSA-N
TotalMolweight	451.346
Molweight	451.346
MonoisotopicMass	451.04253
CLogP	4.1974
CLogS	-4.608
H Acceptors	6
H Donors	1
TotalSurfaceArea	300.42
Relative PSA	0.25002
PolarSurfaceArea	99.93
Druglikeness	-15.948
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46667
Fragments	1
Non HAtoms	30
NonCHAtoms	13
Electronegative Atoms	13
Rotatable Bond	8
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	7
StereoCon

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