Vitas-M small molecule compound
N-(3-carbamoyl-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
Catalog ID
STK304035
SMILES Cn1cc(c(n1)C(=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 C16H19N5O4S MW 377.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N5O4S/c1-20-8-10(21(24)25)13(19-20)15(23)18-16-12(14(17)22)9-6-4-2-3-5-7-11(9)26-16/h8H,2-7H2,1H3,(H2,17,22)(H,18,23)InChIKey
MIQBISOFCZYAIL-UHFFFAOYSA-NSynonyms
1005627-16-61005627166
CN1C=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCCCCC3)C(=O)N)(N+)(=O)(O)
Cn1cc(c(n1)C(=O)Nc1sc2c(c1C(=O)N)CCCCCC2)(N+)(=O)(O)
InChI=1SC16H19N5O4Sc120810(21(24)25)13(1920)15(23)181612(14(17)22)964235711(9)2616h8H27H21H3(H21722)(H1823)
MFCD04043756
N(3carbamoyl456789hexahydrocycloocta(b)thiophen2yl)1methyl4nitro1Hpyrazole3carboxamide
N(3carbamoyl456789hexahydrocycloocta(b)thiophen2yl)1methyl4nitropyrazole3carboxamide
ZINC000002779180
ZINC02779180
ZINC2779180
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