PMX-30016

Details

Stereochemistry	ACHIRAL
Molecular Formula	C36H46F6N14O4S2
Molecular Weight	916.962
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NCCSC1=C(NC(=O)CCCCNC(N)=N)C=C(C=C1NC(=O)C2=CC(=NC=N2)C(=O)NC3=CC(=CC(NC(=O)CCCCNC(N)=N)=C3SCCN)C(F)(F)F)C(F)(F)F

InChI

InChIKey=OHHNVZCJNXFLCJ-UHFFFAOYSA-N

InChI=1S/C36H46F6N14O4S2/c37-35(38,39)19-13-21(53-27(57)5-1-3-9-49-33(45)46)29(61-11-7-43)23(15-19)55-31(59)25-17-26(52-18-51-25)32(60)56-24-16-20(36(40,41)42)14-22(30(24)62-12-8-44)54-28(58)6-2-4-10-50-34(47)48/h13-18H,1-12,43-44H2,(H,53,57)(H,54,58)(H,55,59)(H,56,60)(H4,45,46,49)(H4,47,48,50)

HIDE SMILES / InChI

Molecular Formula	C36H46F6N14O4S2
Molecular Weight	916.962
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 `Mon Mar 31 22:47:16 GMT 2025` Edited by `admin` on `Mon Mar 31 22:47:16 GMT 2025`
Record UNII	HP7FFH4YG6
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PMX-30016

Code

English

4,6-PYRIMIDINEDICARBOXAMIDE, N4,N6-BIS(2-((2-AMINOETHYL)THIO)-3-((5-((AMINOIMINOMETHYL)AMINO)-1-OXOPENTYL)AMINO)-5-(TRIFLUOROMETHYL)PHENYL)-

Preferred Name

English

PMX30016

Code

English

N4,N6-BIS(2-((2-AMINOETHYL)THIO)-3-((5-((AMINOIMINOMETHYL)AMINO)-1-OXOPENTYL)AMINO)-5-(TRIFLUOROMETHYL)PHENYL)-4,6-PYRIMIDINEDICARBOXAMIDE

Systematic Name

English

Code System Code Type Description

CAS

1036714-88-1

Created by admin on Mon Mar 31 22:47:16 GMT 2025 , Edited by admin on Mon Mar 31 22:47:16 GMT 2025

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PUBCHEM

53339816

Created by admin on Mon Mar 31 22:47:16 GMT 2025 , Edited by admin on Mon Mar 31 22:47:16 GMT 2025

PRIMARY

FDA UNII

HP7FFH4YG6

Created by admin on Mon Mar 31 22:47:16 GMT 2025 , Edited by admin on Mon Mar 31 22:47:16 GMT 2025

PRIMARY

Related Record Type Details


					HP7FFH4YG6

PMX-30016

ACTIVE MOIETY