Vitas-M small molecule compound
3-chloro-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-nitro-1-benzothiophene-2-carboxamide
Catalog ID
STK729468
SMILES N#Cc1c(NC(=O)c2sc3c(c2Cl)c(ccc3)[N+](=O)[O-])sc2c1CCC(C2)C
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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 C19H14ClN3O3S2 MW 431.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14ClN3O3S2/c1-9-5-6-10-11(8-21)19(28-14(10)7-9)22-18(24)17-16(20)15-12(23(25)26)3-2-4-13(15)27-17/h2-4,9H,5-7H2,1H3,(H,22,24)InChIKey
MANPOKGAQFMFDX-UHFFFAOYSA-NSynonyms
847478-16-43chloroN(3cyano6methyl4567tetrahydro1benzothiophen2yl)4nitro1benzothiophene2carboxamide
3chloroN(3cyano6methyl4567tetrahydrobenzo(b)thiophen2yl)4nitrobenzo(b)thiophene2carboxamide
847478164
CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=C(C4=C(C=CC=C4S3)(N+)(=O)(O))Cl
InChI=1SC19H14ClN3O3S2c19561011(821)19(2814(10)79)2218(24)1716(20)1512(23(25)26)32413(15)2717h249H57H21H3(H2224)
MFCD06760338
N#Cc1c(NC(=O)c2sc3c(c2Cl)c(ccc3)(N+)(=O)(O))sc2c1CCC(C2)C
ZINC000009066819
ZINC000009066824
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