Vitas-M small molecule compound
dipropan-2-yl 5-{[(4-chloro-2-nitrophenyl)carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK440126
SMILES CC(OC(=O)c1c(NC(=O)c2ccc(cc2[N+](=O)[O-])Cl)sc(c1C)C(=O)OC(C)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 C20H21ClN2O7S MW 468.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN2O7S/c1-9(2)29-19(25)15-11(5)16(20(26)30-10(3)4)31-18(15)22-17(24)13-7-6-12(21)8-14(13)23(27)28/h6-10H,1-5H3,(H,22,24)InChIKey
ZPTSEUVQVNHSEL-UHFFFAOYSA-NSynonyms
CC(OC(=O)c1c(NC(=O)c2ccc(cc2(N+)(=O)(O))Cl)sc(c1C)C(=O)OC(C)C)C
CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=C(C=C(C=C2)Cl)(N+)(=O)(O))C(=O)OC(C)C
dipropan2yl5(((4chloro2nitrophenyl)carbonyl)amino)3methylthiophene24dicarboxylate
DIPROPAN2YL5((4CHLORO2NITROBENZOYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC20H21ClN2O7Sc19(2)2919(25)1511(5)16(20(26)3010(3)4)3118(15)2217(24)137612(21)814(13)23(27)28h610H15H3(H2224)
METHYLETHYL5((4CHLORO2NITROPHENYL)CARBONYLAMINO)3METHYL4((METHYLETHYL)OXYCARBONYL)THIOPHENE2CARBOXYLATE
MFCD03362022
ZINC000002743380
ZINC02743380
ZINC2743380
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