METHYLTHYMOL BLUE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C37H40N2O13S.4Na
Molecular Weight	844.743
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].[Na+].[Na+].CC(C)C1=CC(=C(C)C(CN(CC([O-])=O)CC([O-])=O)=C1O)C2(OS(=O)(=O)C3=C2C=CC=C3)C4=C(C)C(CN(CC([O-])=O)CC([O-])=O)=C(O)C(=C4)C(C)C

InChI

InChIKey=DIZZDZCUMBBRSG-UHFFFAOYSA-J

InChI=1S/C37H44N2O13S.4Na/c1-19(2)23-11-28(21(5)25(35(23)48)13-38(15-31(40)41)16-32(42)43)37(27-9-7-8-10-30(27)53(50,51)52-37)29-12-24(20(3)4)36(49)26(22(29)6)14-39(17-33(44)45)18-34(46)47;;;;/h7-12,19-20,48-49H,13-18H2,1-6H3,(H,40,41)(H,42,43)(H,44,45)(H,46,47);;;;/q;4*+1/p-4

HIDE SMILES / InChI

Approval Year

Name

Type

Language

METHYLTHYMOL BLUE

Common Name

English

NSC-74311

Code

English

METHYLTHYMOL BLUE TETRASODIUM SALT [MI]

Common Name

English

ACETIC ACID,(3H-2,1-BENZOXATHIOL-3-YLIDENEBIS((6-HYDROXY-5-ISOPROPYL-2-METHYL-M-PHENYLENE)METHYLENENITRILO))TETRA-,S,S-DIOXIDE, TETRASODIUM SALT

Systematic Name

English

GLYCINE, N,N'-((1,1-DIOXIDO-3H-2,1-BENZOXATHIOL-3-YLIDENE)BIS((6-HYDROXY-2-METHYL-5-(1-METHYLETHYL)-3,1-PHENYLENE)METHYLENE))BIS(N-(CARBOXYMETHYL)-, SODIUM SALT (1:4)

Systematic Name

English

GLYCINE, N,N'-((1,1-DIOXIDO-3H-2,1-BENZOXATHIOL-3-YLIDENE)BIS((6-HYDROXY-2-METHYL-5-(1-METHYLETHYL)-3,1-PHENYLENE)METHYLENE))BIS(N-(CARBOXYMETHYL)-, TETRASODIUM SALT

Systematic Name

English

TETRASODIUM N,N'-(3H-2,1-BENZOXATHIOL-3-YLIDENEBIS((6- HYDROXY-5-ISOPROPYL-2-METHYLPHEN-3,1-YLENE)METHYLENE))BIS(N- (CARBOXYLATOMETHYL)AMINOACETATE) S,S-DIOXIDE

Systematic Name

English

GLYCINE, N,N'-(3H-2,1-BENZOXATHIOL-3-YLIDENEBIS((6-HYDROXY-2-METHYL-5-(1-METHYLETHYL)-3,1-PHENYLENE)METHYLENE))BIS(N-(CARBOXYMETHYL)-, S,S-DIOXIDE, TETRASODIUM SALT

Systematic Name

English

Code System Code Type Description

PUBCHEM

73037