N,N'-BIS(DES(5-CHLORO-2-CARVOXYTHIENYL) RIVAROXABAN) UREA

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H32N6O9
Molecular Weight	608.5992
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N,N'-BIS(DES(5-CHLORO-2-CARVOXYTHIENYL) RIVAROXABAN) UREA

Structure Search

SMILES

O=C(NC[C@H]1CN(C(=O)O1)C2=CC=C(C=C2)N3CCOCC3=O)NC[C@H]4CN(C(=O)O4)C5=CC=C(C=C5)N6CCOCC6=O

InChI

InChIKey=RMYVVSKNFAMRGJ-ZEQRLZLVSA-N

InChI=1S/C29H32N6O9/c36-25-17-41-11-9-32(25)19-1-5-21(6-2-19)34-15-23(43-28(34)39)13-30-27(38)31-14-24-16-35(29(40)44-24)22-7-3-20(4-8-22)33-10-12-42-18-26(33)37/h1-8,23-24H,9-18H2,(H2,30,31,38)/t23-,24-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H32N6O9
Molecular Weight	608.5992
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:08:28 GMT 2023` Edited by `admin` on `Sat Dec 16 11:08:28 GMT 2023`
Record UNII	2NRT9PD3WJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N,N'-BIS(DES(5-CHLORO-2-CARVOXYTHIENYL) RIVAROXABAN) UREA

Common Name

English

RIVAROXABAN IMPURITY D [EP IMPURITY]

Common Name

English

N,N'-BIS(((5S)-2-OXO-3-(4-(3-OXOMORPHOLIN-4-YL)PHENYL)-1,3-OXAZOLIDIN-5-YL)METHYL)UREA

Systematic Name

English

1,3-BIS(((5S)-2-OXO-3-(4-(3-OXOMORPHOLIN-4-YL)PHENYL)-1,3-OXAZOLIDIN-5-YL)METHYL)UREA

Common Name

English

UREA, N,N'-BIS(((5S)-2-OXO-3-(4-(3-OXO-4-MORPHOLINYL)PHENYL)-5-OXAZOLIDINYL)METHYL)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID901132421