1-METHYLETHYL (8S)-7-((2S)-2-(((1S)-1-(ETHOXYCARBONYL)-3-PHENYLPROPYL)AMINO)PROPANOYL)-1,4-DITHIA-7-AZASPIRO(4.4)NONANE-8-CARBOXYLATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H36N2O5S2
Molecular Weight	508.694
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-METHYLETHYL (8S)-7-((2S)-2-(((1S)-1-(ETHOXYCARBONYL)-3-PHENYLPROPYL)AMINO)PROPANOYL)-1,4-DITHIA-7-AZASPIRO(4.4)NONANE-8-CARBOXYLATE

Structure Search

SMILES

CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CC3(C[C@H]2C(=O)OC(C)C)SCCS3

InChI

InChIKey=KXGPCQDIPFHFIU-JBACZVJFSA-N

InChI=1S/C25H36N2O5S2/c1-5-31-23(29)20(12-11-19-9-7-6-8-10-19)26-18(4)22(28)27-16-25(33-13-14-34-25)15-21(27)24(30)32-17(2)3/h6-10,17-18,20-21,26H,5,11-16H2,1-4H3/t18-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H36N2O5S2
Molecular Weight	508.694
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:36:05 UTC 2023` Edited by `admin` on `Sat Dec 16 14:36:05 UTC 2023`
Record UNII	G4S3MD65F4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-METHYLETHYL (8S)-7-((2S)-2-(((1S)-1-(ETHOXYCARBONYL)-3-PHENYLPROPYL)AMINO)PROPANOYL)-1,4-DITHIA-7-AZASPIRO(4.4)NONANE-8-CARBOXYLATE

Systematic Name

English

SPIRAPRIL HYDROCHLORIDE MONOHYDRATE IMPURITY D [EP IMPURITY]

Common Name

English

ISOPROPYL (2S)-3-((2S)-2-(((1S)-1-ETHOXYCARBONYL-3-PHENYL-PROPYL)AMINO)PROPANOYL)-6,9-DITHIA-3-AZASPIRO(4.4)NONANE-2-CARBOXYLATE

Systematic Name

English

Code System Code Type Description

FDA UNII

G4S3MD65F4

Created by admin on Sat Dec 16 14:36:05 UTC 2023 , Edited by admin on Sat Dec 16 14:36:05 UTC 2023

PRIMARY

PUBCHEM

155928876

Created by admin on Sat Dec 16 14:36:05 UTC 2023 , Edited by admin on Sat Dec 16 14:36:05 UTC 2023

PRIMARY

Related Record Type Details


					9E0E9OWH0B

SPIRAPRIL HYDROCHLORIDE MONOHYDRATE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: