N-[2-[2,4-bis(ethenylcarbamothioyl)-5-oxo-3-sulfanylidene-1,2,4-triazin-6-yl]phenyl]-2,2,2-trifluoroacetamide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H13F3N6O2S3
Molecular Weight	486.514
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-[2-[2,4-bis(ethenylcarbamothioyl)-5-oxo-3-sulfanylidene-1,2,4-triazin-6-yl]phenyl]-2,2,2-trifluoroacetamide

Structure Search

SMILES

FC(F)(F)C(=O)NC1=CC=CC=C1C2=NN(C(=S)NC=C)C(=S)N(C(=S)NC=C)C2=O

InChI

InChIKey=FFLNCWNLBCUZJK-UHFFFAOYSA-N

InChI=1S/C17H13F3N6O2S3/c1-3-21-14(29)25-12(27)11(24-26(16(25)31)15(30)22-4-2)9-7-5-6-8-10(9)23-13(28)17(18,19)20/h3-8H,1-2H2,(H,21,29)(H,22,30)(H,23,28)

HIDE SMILES / InChI

Molecular Formula	C17H13F3N6O2S3
Molecular Weight	486.514
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:51:52 GMT 2023` Edited by `admin` on `Sat Dec 16 12:51:52 GMT 2023`
Record UNII	K6FZY58H95
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-[2-[2,4-bis(ethenylcarbamothioyl)-5-oxo-3-sulfanylidene-1,2,4-triazin-6-yl]phenyl]-2,2,2-trifluoroacetamide

Systematic Name

English

3-Thioxo-2,4-Di(N-vinylaminothioxomethyl)-6-(2-trifluoroacetylaminophenyl)-1,2,4-triazine-5(2H,4H)-one

Common Name

English

N-[2-[2,4-Bis[(ethenylamino)thioxomethyl]-2,3,4,5-tetrahydro-5-oxo-3-thioxo-1,2,4-triazin-6-yl]phenyl]-2,2,2-trifluoroacetamide

Systematic Name

English

Acetamide, N-(2-(2,4-bis((ethenylamino)thioxomethyl)-2,3,4,5-tetrahydro-5-oxo-3-thioxo-1,2,4-triazin-6-yl)phenyl)-2,2,2-trifluoro-

Systematic Name

English

NSC-623092

Code

English

Code System Code Type Description

PUBCHEM

3000332