Vitas-M small molecule compound
N-(6-tert-butyl-3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,5-dimethyl-4-nitro-1H-pyrazole-3-carboxamide
Catalog ID
STK304617
SMILES NC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1nn(c(c1[N+](=O)[O-])C)C
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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 C19H25N5O4S MW 419.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N5O4S/c1-9-15(24(27)28)14(22-23(9)5)17(26)21-18-13(16(20)25)11-7-6-10(19(2,3)4)8-12(11)29-18/h10H,6-8H2,1-5H3,(H2,20,25)(H,21,26)InChIKey
ZTEFMFFIOCLEJB-UHFFFAOYSA-NSynonyms
1005658-04-71005658047
CC1=C(C(=NN1C)C(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N)(N+)(=O)(O)
InChI=1SC19H25N5O4Sc1915(24(27)28)14(2223(9)5)17(26)211813(16(20)25)117610(19(23)4)812(11)2918h10H68H215H3(H22025)(H2126)
MFCD04043538
N(6tertbutyl3carbamoyl4567tetrahydro1benzothiophen2yl)15dimethyl4nitro1Hpyrazole3carboxamide
N(6tertbutyl3carbamoyl4567tetrahydro1benzothiophen2yl)15dimethyl4nitropyrazole3carboxamide
NC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1nn(c(c1(N+)(=O)(O))C)C
ZINC000002781499
ZINC000002781500
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