Vitas-M small molecule compound
2-{[(2-nitrophenyl)carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Catalog ID
STK430696
SMILES NC(=O)c1c(sc2c1CCCCCC2)NC(=O)c1ccccc1[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 C18H19N3O4S MW 373.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O4S/c19-16(22)15-12-8-3-1-2-4-10-14(12)26-18(15)20-17(23)11-7-5-6-9-13(11)21(24)25/h5-7,9H,1-4,8,10H2,(H2,19,22)(H,20,23)InChIKey
CGGNDUKWQOVKLT-UHFFFAOYSA-NSynonyms
2(((2nitrophenyl)carbonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
2((2nitrobenzoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
C1CCCC2=C(CC1)C(=C(S2)NC(=O)C3=CC=CC=C3(N+)(=O)(O))C(=O)N
InChI=1SC18H19N3O4Sc1916(22)1512831241014(12)2618(15)2017(23)11756913(11)21(24)25h579H14810H2(H21922)(H2023)
MFCD01340220
NC(=O)c1c(sc2c1CCCCCC2)NC(=O)c1ccccc1(N+)(=O)(O)
ZINC000001199999
ZINC01199999
ZINC1199999
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