Vitas-M small molecule compound
2-{[(2-chloro-5-nitrophenyl)carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Catalog ID
STK447578
SMILES Clc1ccc(cc1C(=O)Nc1sc2c(c1C(=O)N)CCCCCC2)[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 C18H18ClN3O4S MW 407.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O4S/c19-13-8-7-10(22(25)26)9-12(13)17(24)21-18-15(16(20)23)11-5-3-1-2-4-6-14(11)27-18/h7-9H,1-6H2,(H2,20,23)(H,21,24)InChIKey
IFHXVZUOCFPLMA-UHFFFAOYSA-NSynonyms
2(((2chloro5nitrophenyl)carbonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
2((2chloro5nitrobenzoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
C1CCCC2=C(CC1)C(=C(S2)NC(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Cl)C(=O)N
Clc1ccc(cc1C(=O)Nc1sc2c(c1C(=O)N)CCCCCC2)(N+)(=O)(O)
InChI=1SC18H18ClN3O4Sc19138710(22(25)26)912(13)17(24)211815(16(20)23)1153124614(11)2718h79H16H2(H22023)(H2124)
MFCD01343540
ZINC000002922295
ZINC02922295
ZINC2922295
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