Vitas-M small molecule compound
2-{[(2-nitrophenyl)carbonyl]amino}-N-(tetrahydrofuran-2-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK876566
SMILES O=C(c1c(sc2c1CCCC2)NC(=O)c1ccccc1[N+](=O)[O-])NCC1CCCO1
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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 C21H23N3O5S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O5S/c25-19(14-7-1-3-9-16(14)24(27)28)23-21-18(15-8-2-4-10-17(15)30-21)20(26)22-12-13-6-5-11-29-13/h1,3,7,9,13H,2,4-6,8,10-12H2,(H,22,26)(H,23,25)InChIKey
KCEKLXUYQLMUCD-UHFFFAOYSA-NSynonyms
381680-10-02(((2nitrophenyl)carbonyl)amino)N(tetrahydrofuran2ylmethyl)4567tetrahydro1benzothiophene3carboxamide
2((2nitrobenzoyl)amino)N(oxolan2ylmethyl)4567tetrahydro1benzothiophene3carboxamide
2(2nitrobenzamido)N((tetrahydrofuran2yl)methyl)4567tetrahydrobenzo(b)thiophene3carboxamide
381680100
C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3(N+)(=O)(O))C(=O)NCC4CCCO4
InChI=1SC21H23N3O5Sc2519(14713916(14)24(27)28)232118(158241017(15)3021)20(26)22121365112913h137913H24681012H2(H2226)(H2325)
MFCD02978013
ZINC000001166084
ZINC000001166085
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