Vitas-M small molecule compound
4-methyl-5-[(4-methylphenyl)carbamoyl]-2-{[(4-nitrophenyl)carbonyl]amino}thiophen-3-yl propanoate
Catalog ID
STK957046
SMILES CCC(=O)Oc1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])sc(c1C)C(=O)Nc1ccc(cc1)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 C23H21N3O6S MW 467.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O6S/c1-4-18(27)32-19-14(3)20(22(29)24-16-9-5-13(2)6-10-16)33-23(19)25-21(28)15-7-11-17(12-8-15)26(30)31/h5-12H,4H2,1-3H3,(H,24,29)(H,25,28)InChIKey
UJLPBFAWQPLOQD-UHFFFAOYSA-NSynonyms
362497-73-2(4METHYL5((4METHYLPHENYL)CARBAMOYL)2((4NITROBENZOYL)AMINO)THIOPHEN3YL)PROPANOATE
2((4NITROBENZOYL)AMINO)4METHYL5(4TOLUIDINOCARBONYL)3THIENYLPROPIONATE
362497732
4methyl5((4methylphenyl)carbamoyl)2(((4nitrophenyl)carbonyl)amino)thiophen3ylpropanoate
CCC(=O)OC1=C(SC(=C1C)C(=O)NC2=CC=C(C=C2)C)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
CCC(=O)Oc1c(NC(=O)c2ccc(cc2)(N+)(=O)(O))sc(c1C)C(=O)Nc1ccc(cc1)C
InChI=1SC23H21N3O6Sc1418(27)321914(3)20(22(29)24169513(2)61016)3323(19)2521(28)1571117(12815)26(30)31h512H4H213H3(H2429)(H2528)
MFCD01451160
ZINC000002100636
ZINC02100636
ZINC2100636
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