ISOMETAMIDIUM HYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H26N7.Cl.ClH
Molecular Weight	532.467
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of ISOMETAMIDIUM HYDROCHLORIDE

Structure Search

SMILES

Cl.[Cl-].CC[N+]1=C(C2=CC=CC=C2)C3=CC(=CC=C3C4=C1C=C(N)C=C4)\N=N\NC5=CC(=CC=C5)C(N)=N

InChI

InChIKey=URSFPCGNENDEFB-UHFFFAOYSA-N

InChI=1S/C28H25N7.2ClH/c1-2-35-26-16-20(29)11-13-24(26)23-14-12-22(17-25(23)27(35)18-7-4-3-5-8-18)33-34-32-21-10-6-9-19(15-21)28(30)31;;/h3-17,29H,2H2,1H3,(H4,30,31,32,33);2*1H

HIDE SMILES / InChI

Molecular Formula	C28H25N7
Molecular Weight	459.545
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	ClH
Molecular Weight	36.461
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 22:35:32 GMT 2025` Edited by `admin` on `Mon Mar 31 22:35:32 GMT 2025`
Record UNII	6A4LXY935H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-524503

Preferred Name

English

ISOMETAMIDIUM HYDROCHLORIDE

Common Name

English

Phenanthridinium, 3-amino-8-[3-[3-(aminoiminomethyl)phenyl]-1-triazenyl]-5-ethyl-6-phenyl-, chloride, monohydrochloride

Systematic Name

English

Isometamidium chloride hydrochloride

Common Name

English

8-[3-(m-Amidinophenyl)-2-triazeno]-3-amino-5-ethyl-6-phenylphenanthridinium chloride, hydrochloride

Systematic Name

English

3-Amino-8-(3-(3-carbamimidoylphenyl)triaz-2-en-1-yl)-5-ethyl-6-phenylphenanthridin-5-ium chloride hydrochloride

Systematic Name

English

Phenanthridinium, 3-amino-8-[3-[3-(aminoiminomethyl)phenyl]-2-triazen-1-yl]-5-ethyl-6-phenyl-, chloride, hydrochloride (1:1:1)

Systematic Name

English

veridium

Common Name

English

Trypamidium

Common Name

English

Samorin

Common Name

English

Code System Code Type Description

FDA UNII

6A4LXY935H