Vitas-M small molecule compound
methyl 2-{[(4-chloro-2-nitrophenyl)carbonyl]amino}-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Catalog ID
STK427801
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)c1ccc(cc1[N+](=O)[O-])Cl)CC
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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 C19H20ClN3O6S MW 453.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20ClN3O6S/c1-5-22(6-2)18(25)15-10(3)14(19(26)29-4)17(30-15)21-16(24)12-8-7-11(20)9-13(12)23(27)28/h7-9H,5-6H2,1-4H3,(H,21,24)InChIKey
DRLBXUCDAGORKZ-UHFFFAOYSA-NSynonyms
CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)c1ccc(cc1(N+)(=O)(O))Cl)CC
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=C(C=C(C=C2)Cl)(N+)(=O)(O))C(=O)OC)C
InChI=1SC19H20ClN3O6Sc1522(62)18(25)1510(3)14(19(26)294)17(3015)2116(24)128711(20)913(12)23(27)28h79H56H214H3(H2124)
methyl2(((4chloro2nitrophenyl)carbonyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
METHYL2((4CHLORO2NITROBENZOYL)AMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5(NNDIETHYLCARBAMOYL)2((4CHLORO2NITROPHENYL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD01343326
ZINC000001201051
ZINC01201051
ZINC1201051
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