Vitas-M small molecule compound
methyl 4-ethyl-5-methyl-2-[({2-[(3,4,5-triethoxyphenyl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate
Catalog ID
STK455911
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)NNC(=S)Nc1sc(c(c1C(=O)OC)CC)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 C23H31N3O6S2 MW 509.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N3O6S2/c1-7-15-13(5)34-21(18(15)22(28)29-6)24-23(33)26-25-20(27)14-11-16(30-8-2)19(32-10-4)17(12-14)31-9-3/h11-12H,7-10H2,1-6H3,(H,25,27)(H2,24,26,33)InChIKey
XHPUGQBOUPNORC-UHFFFAOYSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)C2=CC(=C(C(=C2)OCC)OCC)OCC)C
InChI=1SC23H31N3O6S2c171513(5)3421(18(15)22(28)296)2423(33)262520(27)141116(3082)19(32104)17(1214)3193h1112H710H216H3(H2527)(H2242633)
methyl4ethyl5methyl2(((2((345triethoxyphenyl)carbonyl)hydrazinyl)carbonothioyl)amino)thiophene3carboxylate
METHYL4ETHYL5METHYL2(((345TRIETHOXYBENZOYL)AMINO)CARBAMOTHIOYLAMINO)THIOPHENE3CARBOXYLATE
METHYL4ETHYL5METHYL2((THIOXO(((345TRIETHOXYPHENYL)CARBONYLAMINO)AMINO)METHYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD04137461
ZINC000016345511
ZINC16345511
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