TIAFENACIL

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H18ClF4N3O5S
Molecular Weight	511.875
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC(=O)CCNC(=O)C(C)SC1=CC(N2C(=O)C=C(N(C)C2=O)C(F)(F)F)=C(F)C=C1Cl

InChI

InChIKey=QPTPZPIXUPELRM-UHFFFAOYSA-N

InChI=1S/C19H18ClF4N3O5S/c1-9(17(30)25-5-4-16(29)32-3)33-13-7-12(11(21)6-10(13)20)27-15(28)8-14(19(22,23)24)26(2)18(27)31/h6-9H,4-5H2,1-3H3,(H,25,30)

HIDE SMILES / InChI

Molecular Formula	C19H18ClF4N3O5S
Molecular Weight	511.875
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 10:12:56 GMT 2025` Edited by `admin` on `Wed Apr 02 10:12:56 GMT 2025`
Record UNII	6LL8M8V4YB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TIAFENACIL

Official Name

English

TIAFENACIL [ISO]

Preferred Name

English

METHYL N-(2-((2-CHLORO-5-(3,6-DIHYDRO-3-METHYL-2,6-DIOXO-4-(TRIFLUOROMETHYL)-1(2H)-PYRIMIDINYL)-4-FLUOROPHENYL)THIO)-1-OXOPROPYL)-.BETA.-ALANINATE

Systematic Name

English

.BETA.-ALANINE, N-(2-((2-CHLORO-5-(3,6-DIHYDRO-3-METHYL-2,6-DIOXO-4-(TRIFLUOROMETHYL)-1(2H)-PYRIMIDINYL)-4-FLUOROPHENYL)THIO)-1-OXOPROPYL)-, METHYL ESTER

Systematic Name

English

METHYL RAC-3-((2R)-2-((2-CHLORO-5-(3-METHYL-2,6-DIOXO-4-(TRIFLUOROMETHYL)-3,6-DIHYDROPYRIMIDIN-1(2H)-YL)-4-FLUOROPHENYL)SULFANYL)PROPANAMIDO)PROPANOATE

Systematic Name

English

METHYL 3-(((2RS)-2-((2-CHLORO-5-(3-METHYL-2,6-DIOXO-4-(TRIFLUOROMETHYL)-3,6-DIHYDROPYRIMIDIN-1(2H)-YL)-4-FLUOROPHENYL)THIO)PROPANOYL)AMINO)PROPANOATE

Systematic Name

English

METHYL 3-((2RS)-2-((2-CHLORO-5-(3,6-DIHYDRO-3-METHYL-2,6-DIOXO-4-(TRIFLUOROMETHYL)PYRIMIDIN-1(2H)-YL)-4-FLUOROPHENYL)THIO)PROPIONAMIDO)PROPIONATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

67295585