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Details

Stereochemistry ACHIRAL
Molecular Formula C33H35N5O5
Molecular Weight 581.6615
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Methyl (3Z)-1-acetyl-2,3-dihydro-3-[[[4-[methyl[2-(4-methyl-1-piperazinyl)acetyl]amino]phenyl]amino]phenylmethylene]-2-oxo-1H-indole-6-carboxylate

SMILES

COC(=O)C1=CC=C2C(=C1)N(C(C)=O)C(=O)\C2=C(/NC3=CC=C(C=C3)N(C)C(=O)CN4CCN(C)CC4)C5=CC=CC=C5

InChI

InChIKey=GWLPYOBWKYHZQP-KTMFPKCZSA-N
InChI=1S/C33H35N5O5/c1-22(39)38-28-20-24(33(42)43-4)10-15-27(28)30(32(38)41)31(23-8-6-5-7-9-23)34-25-11-13-26(14-12-25)36(3)29(40)21-37-18-16-35(2)17-19-37/h5-15,20,34H,16-19,21H2,1-4H3/b31-30-

HIDE SMILES / InChI

Molecular Formula C33H35N5O5
Molecular Weight 581.6615
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 23:16:23 UTC 2023
Edited
by admin
on Thu Jul 06 23:16:23 UTC 2023
Record UNII
D554S7YM3D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Methyl (3Z)-1-acetyl-2,3-dihydro-3-[[[4-[methyl[2-(4-methyl-1-piperazinyl)acetyl]amino]phenyl]amino]phenylmethylene]-2-oxo-1H-indole-6-carboxylate
Systematic Name English
1H-Indole-6-carboxylic acid, 1-acetyl-2,3-dihydro-3-[[[4-[methyl[2-(4-methyl-1-piperazinyl)acetyl]amino]phenyl]amino]phenylmethylene]-2-oxo-, methyl ester, (3Z)-
Systematic Name English
Code System Code Type Description
FDA UNII
D554S7YM3D
Created by admin on Thu Jul 06 23:16:23 UTC 2023 , Edited by admin on Thu Jul 06 23:16:23 UTC 2023
PRIMARY
CAS
2380229-45-6
Created by admin on Thu Jul 06 23:16:23 UTC 2023 , Edited by admin on Thu Jul 06 23:16:23 UTC 2023
PRIMARY
Related Record Type Details
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