Vitas-M small molecule compound
2-{[(4-chloro-3-nitrophenyl)carbonyl]amino}-N-(furan-2-ylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Catalog ID
STK814187
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])Cl)Nc1sc2c(c1C(=O)NCc1ccco1)CCC2
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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 C20H16ClN3O5S MW 445.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN3O5S/c21-14-7-6-11(9-15(14)24(27)28)18(25)23-20-17(13-4-1-5-16(13)30-20)19(26)22-10-12-3-2-8-29-12/h2-3,6-9H,1,4-5,10H2,(H,22,26)(H,23,25)InChIKey
XLVXTYSKKHILNB-UHFFFAOYSA-NSynonyms
2(((4chloro3nitrophenyl)carbonyl)amino)N(furan2ylmethyl)56dihydro4Hcyclopenta(b)thiophene3carboxamide
2((4CHLORO3NITROBENZOYL)AMINO)N(FURAN2YLMETHYL)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXAMIDE
2C(4CHLORO3NITROBENZENE)3N(FURAN2YLMETHYL)4H5H6HCYCLOPENTA(B)THIOPHENE23DICARBOXAMIDE
C1CC2=C(C1)SC(=C2C(=O)NCC3=CC=CO3)NC(=O)C4=CC(=C(C=C4)Cl)(N+)(=O)(O)
InChI=1SC20H16ClN3O5Sc21147611(915(14)24(27)28)18(25)232017(1341516(13)3020)19(26)2210123282912h2369H14510H2(H2226)(H2325)
MFCD03721717
O=C(c1ccc(c(c1)(N+)(=O)(O))Cl)Nc1sc2c(c1C(=O)NCc1ccco1)CCC2
ZINC000002830629
ZINC02830629
ZINC2830629
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