Vitas-M small molecule compound
5-(2-chloro-4-nitrophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)furan-2-carboxamide
Catalog ID
STK949708
SMILES N#Cc1c(NC(=O)c2ccc(o2)c2ccc(cc2Cl)[N+](=O)[O-])sc2c1CCCC2
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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 C20H14ClN3O4S MW 427.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClN3O4S/c21-15-9-11(24(26)27)5-6-13(15)16-7-8-17(28-16)19(25)23-20-14(10-22)12-3-1-2-4-18(12)29-20/h5-9H,1-4H2,(H,23,25)InChIKey
YYFLJXOCXLAICC-UHFFFAOYSA-NSynonyms
618397-23-25(2chloro4nitrophenyl)N(3cyano4567tetrahydro1benzothiophen2yl)furan2carboxamide
5(2chloro4nitrophenyl)N(3cyano4567tetrahydrobenzo(b)thiophen2yl)furan2carboxamide
618397232
C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(O3)C4=C(C=C(C=C4)(N+)(=O)(O))Cl)C#N
InChI=1SC20H14ClN3O4Sc2115911(24(26)27)5613(15)167817(2816)19(25)232014(1022)12312418(12)2920h59H14H2(H2325)
MFCD04172722
N#Cc1c(NC(=O)c2ccc(o2)c2ccc(cc2Cl)(N+)(=O)(O))sc2c1CCCC2
ZINC000001108456
ZINC01108456
ZINC1108456
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