Vitas-M small molecule compound
methyl 5-ethyl-2-{[(4-methoxy-2-nitrophenyl)carbamothioyl]amino}thiophene-3-carboxylate
Catalog ID
STK455108
SMILES COc1ccc(c(c1)[N+](=O)[O-])NC(=S)Nc1sc(cc1C(=O)OC)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 C16H17N3O5S2 MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O5S2/c1-4-10-8-11(15(20)24-3)14(26-10)18-16(25)17-12-6-5-9(23-2)7-13(12)19(21)22/h5-8H,4H2,1-3H3,(H2,17,18,25)InChIKey
XBBLPCFQWMLHRC-UHFFFAOYSA-NSynonyms
CCC1=CC(=C(S1)NC(=S)NC2=C(C=C(C=C2)OC)(N+)(=O)(O))C(=O)OC
COc1ccc(c(c1)(N+)(=O)(O))NC(=S)Nc1sc(cc1C(=O)OC)CC
InChI=1SC16H17N3O5S2c1410811(15(20)243)14(2610)1816(25)1712659(232)713(12)19(21)22h58H4H213H3(H2171825)
METHYL5ETHYL2((((4METHOXY2NITROPHENYL)AMINO)THIOXOMETHYL)AMINO)THIOPHENE3CARBOXYLATE
methyl5ethyl2(((4methoxy2nitrophenyl)carbamothioyl)amino)thiophene3carboxylate
METHYL5ETHYL2((4METHOXY2NITROPHENYL)CARBAMOTHIOYLAMINO)THIOPHENE3CARBOXYLATE
MFCD04228351
ZINC000005041408
ZINC05041408
ZINC5041408
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