Vitas-M small molecule compound
N-(3-cyano-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-2-yl)-3-nitro-4-(pyrrolidin-1-yl)benzamide
Catalog ID
STK327544
SMILES N#CC1=C(NC(=O)c2ccc(c(c2)[N+](=O)[O-])N2CCCC2)SC2C1CCC2
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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 C19H20N4O3S MW 384.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O3S/c20-11-14-13-4-3-5-17(13)27-19(14)21-18(24)12-6-7-15(16(10-12)23(25)26)22-8-1-2-9-22/h6-7,10,13,17H,1-5,8-9H2,(H,21,24)InChIKey
PVAGENFGYOHXRV-UHFFFAOYSA-NSynonyms
638145-54-7638145547
C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C4CCCC4S3)C#N)(N+)(=O)(O)
InChI=1SC19H20N4O3Sc2011141343517(13)2719(14)2118(24)126715(16(1012)23(25)26)22812922h67101317H1589H2(H2124)
MFCD03909993
N#CC1=C(NC(=O)c2ccc(c(c2)(N+)(=O)(O))N2CCCC2)SC2C1CCC2
N(3cyano4566atetrahydro3aHcyclopenta(b)thiophen2yl)3nitro4(pyrrolidin1yl)benzamide
N(3cyano4566atetrahydro3aHcyclopenta(b)thiophen2yl)3nitro4pyrrolidin1ylbenzamide
ZINC000005025209
ZINC000005025212
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