Vitas-M small molecule compound
2-{[(2-methyl-3-nitrophenyl)carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Catalog ID
STK419279
SMILES NC(=O)c1c(sc2c1CCCCCC2)NC(=O)c1cccc(c1C)[N+](=O)[O-]
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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 C19H21N3O4S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O4S/c1-11-12(8-6-9-14(11)22(25)26)18(24)21-19-16(17(20)23)13-7-4-2-3-5-10-15(13)27-19/h6,8-9H,2-5,7,10H2,1H3,(H2,20,23)(H,21,24)InChIKey
PFJYRWCYBHNTEC-UHFFFAOYSA-NSynonyms
352683-03-52(((2methyl3nitrophenyl)carbonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
2((2methyl3nitrobenzoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
352683035
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)NC2=C(C3=C(S2)CCCCCC3)C(=O)N
InChI=1SC19H21N3O4Sc11112(86914(11)22(25)26)18(24)211916(17(20)23)13742351015(13)2719h689H25710H21H3(H22023)(H2124)
MFCD01351929
NC(=O)c1c(sc2c1CCCCCC2)NC(=O)c1cccc(c1C)(N+)(=O)(O)
ZINC000000996339
ZINC00996339
ZINC996339
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