CAS Registry Number: 4604-72-2

Name:

2-​Pyrazinecarbothioami​de
Pyrazinecarbothioami​de (9CI); Pyrazinecarboxamide, thio- (7CI,​8CI); 2-​Pyrazinethiocarboxam​ide; NSC 18377; Pyrazine-​2-​carbothioamide; Pyrazinecarboxylic acid thioamide; Pyrazinethiocarboxam​ide 

Chemical Formula: C5H5N3S
Exact Mass: 139.02
Molecular Weight: 139.18
m/z: 139.02 (100.0%), 140.02 (7.3%), 141.02 (4.6%)
Elemental Analysis: C, 43.15; H, 3.62; N, 30.19; S, 23.04

InChI: InChI=1S/C5H5N3S/c6-5(9)4-3-7-1-2-8-4/h1-3H,(H2,6,9)
InChIKey: LIURPUMROGYCLW-UHFFFAOYSA-N
Canonical SMILES : C1=CN=C(C=N1)C(=S)N

Specification

98%

1. (1) Foks, Henryk; Acta Poloniae Pharmaceutica 1979, V36(2), P155-60 CAPLUS