5-(((3R,4R)-4-AMINO-3-HYDROXY-1-PIPERIDINYL)METHYL)-4-((3-METHOXYPHENYL)AMINO)PYRROLO(2,1-F)(1,2,4)TRIAZIN-7-OL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H24N6O3
Molecular Weight	384.433
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-(((3R,4R)-4-AMINO-3-HYDROXY-1-PIPERIDINYL)METHYL)-4-((3-METHOXYPHENYL)AMINO)PYRROLO(2,1-F)(1,2,4)TRIAZIN-7-OL

Structure Search

SMILES

COc1cccc(c1)N=c2c3c(cc(n3[nH]cn2)O)CN4CC[C@]([H])([C@@]([H])(C4)O)N

InChI

InChIKey=ZEAZUHCIHNWVTH-HZPDHXFCSA-N

InChI=1S/C19H24N6O3/c1-28-14-4-2-3-13(8-14)23-19-18-12(7-17(27)25(18)22-11-21-19)9-24-6-5-15(20)16(26)10-24/h2-4,7-8,11,15-16,26-27H,5-6,9-10,20H2,1H3,(H,21,22,23)/t15-,16-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H24N6O3
Molecular Weight	384.433
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 `Fri Jun 25 20:32:34 UTC 2021` Edited by `admin` on `Fri Jun 25 20:32:34 UTC 2021`
Record UNII	N9XQ32VYQ7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-(((3R,4R)-4-AMINO-3-HYDROXY-1-PIPERIDINYL)METHYL)-4-((3-METHOXYPHENYL)AMINO)PYRROLO(2,1-F)(1,2,4)TRIAZIN-7-OL

Systematic Name

English

PYRROLO(2,1-F)(1,2,4)TRIAZIN-7-OL, 5-(((3R,4R)-4-AMINO-3-HYDROXY-1-PIPERIDINYL)METHYL)-4-((3-METHOXYPHENYL)AMINO)-

Systematic Name

English

BMS-690514 METABOLITE M37

Common Name

English

Code System Code Type Description

CAS

1248590-49-9

Created by admin on Fri Jun 25 20:32:34 UTC 2021 , Edited by admin on Fri Jun 25 20:32:34 UTC 2021

PRIMARY

FDA UNII

N9XQ32VYQ7

Created by admin on Fri Jun 25 20:32:34 UTC 2021 , Edited by admin on Fri Jun 25 20:32:34 UTC 2021

PRIMARY

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