Vitas-M small molecule compound
propan-2-yl 2-{[(2,4-dinitrophenyl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK427694
SMILES CC1CCc2c(C1)sc(c2C(=O)OC(C)C)NC(=O)c1ccc(cc1[N+](=O)[O-])[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 C20H21N3O7S MW 447.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O7S/c1-10(2)30-20(25)17-14-6-4-11(3)8-16(14)31-19(17)21-18(24)13-7-5-12(22(26)27)9-15(13)23(28)29/h5,7,9-11H,4,6,8H2,1-3H3,(H,21,24)InChIKey
OOOXSRREYCNUAM-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)C3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
CC1CCc2c(C1)sc(c2C(=O)OC(C)C)NC(=O)c1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC20H21N3O7Sc110(2)3020(25)17146411(3)816(14)3119(17)2118(24)137512(22(26)27)915(13)23(28)29h57911H468H213H3(H2124)
MFCD01243633
propan2yl2(((24dinitrophenyl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
propan2yl2((24dinitrobenzoyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ZINC000002080092
ZINC000002080093
Check stock
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