Vitas-M small molecule compound
(2E)-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK006084
SMILES N#Cc1c(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])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 C17H13N3O3S MW 339.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O3S/c18-10-14-13-5-2-6-15(13)24-17(14)19-16(21)8-7-11-3-1-4-12(9-11)20(22)23/h1,3-4,7-9H,2,5-6H2,(H,19,21)/b8-7+InChIKey
KXUHUQWLILOAEE-BQYQJAHWSA-NSynonyms
(2E)N(3CYANO(456TRIHYDROCYCLOPENTA(12D)THIOPHEN2YL))3(3NITROPHENYL)PROP2ENAMIDE
(2E)N(3CYANO56DIHYDRO4HCYCLOPENTA(B)THIOPHEN2YL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N(3CYANO56DIHYDRO4HCYCLOPENTA(B)THIOPHEN2YL)3(3NITROPHENYL)PROP2ENAMIDE
C1CC2=C(C1)SC(=C2C#N)NC(=O)C=CC3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC17H13N3O3Sc1810141352615(13)2417(14)1916(21)871131412(911)20(22)23h13479H256H2(H1921)b87+
MFCD01180187
N#Cc1c(NC(=O)C=Cc2cccc(c2)(N+)(=O)(O))sc2c1CCC2
STK006084
ZINC000000038722
ZINC00038722
ZINC38722
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