U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C20H24N2OS
Molecular Weight 340.482
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BOTIACRINE

SMILES

CN(C)CCSC(=O)N1C2=CC=CC=C2C(C)(C)C3=C1C=CC=C3

InChI

InChIKey=QXRUCDDVUMKOPI-UHFFFAOYSA-N
InChI=1S/C20H24N2OS/c1-20(2)15-9-5-7-11-17(15)22(18-12-8-6-10-16(18)20)19(23)24-14-13-21(3)4/h5-12H,13-14H2,1-4H3

HIDE SMILES / InChI
Name Type Language
BOTIACRINE
INN  
INN  
Official Name English
S-(2-(DIMETHYLAMINO)ETHYL)-9,9-DIMETHYL-10-ACRIDANCARBOTHIOATE
Systematic Name English
botiacrine [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C38149
Created by admin on Fri Dec 15 16:05:55 GMT 2023 , Edited by admin on Fri Dec 15 16:05:55 GMT 2023
NCI_THESAURUS C66884
Created by admin on Fri Dec 15 16:05:55 GMT 2023 , Edited by admin on Fri Dec 15 16:05:55 GMT 2023
Code System Code Type Description
EVMPD
SUB05878MIG
Created by admin on Fri Dec 15 16:05:55 GMT 2023 , Edited by admin on Fri Dec 15 16:05:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID60963925
Created by admin on Fri Dec 15 16:05:55 GMT 2023 , Edited by admin on Fri Dec 15 16:05:55 GMT 2023
PRIMARY
FDA UNII
032WJR708Q
Created by admin on Fri Dec 15 16:05:55 GMT 2023 , Edited by admin on Fri Dec 15 16:05:55 GMT 2023
PRIMARY
PUBCHEM
71202
Created by admin on Fri Dec 15 16:05:55 GMT 2023 , Edited by admin on Fri Dec 15 16:05:55 GMT 2023
PRIMARY
ChEMBL
CHEMBL2106109
Created by admin on Fri Dec 15 16:05:55 GMT 2023 , Edited by admin on Fri Dec 15 16:05:55 GMT 2023
PRIMARY
INN
3624
Created by admin on Fri Dec 15 16:05:55 GMT 2023 , Edited by admin on Fri Dec 15 16:05:55 GMT 2023
PRIMARY
CAS
4774-53-2
Created by admin on Fri Dec 15 16:05:55 GMT 2023 , Edited by admin on Fri Dec 15 16:05:55 GMT 2023
PRIMARY
NCI_THESAURUS
C74163
Created by admin on Fri Dec 15 16:05:55 GMT 2023 , Edited by admin on Fri Dec 15 16:05:55 GMT 2023
PRIMARY
SMS_ID
100000088639
Created by admin on Fri Dec 15 16:05:55 GMT 2023 , Edited by admin on Fri Dec 15 16:05:55 GMT 2023
PRIMARY