Vitas-M small molecule compound
4-[(3-chloro-6-nitro-1-benzothiophen-2-yl)carbonyl]-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide
Catalog ID
STK304365
SMILES S=C(N1CCN(CC1)C(=O)c1sc2c(c1Cl)ccc(c2)[N+](=O)[O-])NCC1CCCO1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H21ClN4O4S2 MW 468.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN4O4S2/c20-16-14-4-3-12(24(26)27)10-15(14)30-17(16)18(25)22-5-7-23(8-6-22)19(29)21-11-13-2-1-9-28-13/h3-4,10,13H,1-2,5-9,11H2,(H,21,29)InChIKey
YGGHNYCKEXFSFK-UHFFFAOYSA-NSynonyms
701276-69-94((3CHLORO6NITRO1BENZOTHIOPHEN2YL)CARBONYL)N((2R)TETRAHYDROFURAN2YLMETHYL)PIPERAZINE1CARBOTHIOAMIDE
4((3chloro6nitro1benzothiophen2yl)carbonyl)N(tetrahydrofuran2ylmethyl)piperazine1carbothioamide
4(3CHLORO6NITRO1BENZOTHIOPHENE2CARBONYL)N(OXOLAN2YLMETHYL)PIPERAZINE1CARBOTHIOAMIDE
701276699
C1CC(OC1)CNC(=S)N2CCN(CC2)C(=O)C3=C(C4=C(S3)C=C(C=C4)(N+)(=O)(O))Cl
InChI=1SC19H21ClN4O4S2c2016144312(24(26)27)1015(14)3017(16)18(25)225723(8622)19(29)2111132192813h341013H125911H2(H2129)
MFCD04129459
S=C(N1CCN(CC1)C(=O)c1sc2c(c1Cl)ccc(c2)(N+)(=O)(O))NCC1CCCO1
ZINC000001117544
ZINC000001117545
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