Vitas-M small molecule compound
methyl 2-{[(3-hydroxyphenyl)carbamothioyl]amino}-5-methyl-4-phenylthiophene-3-carboxylate
Catalog ID
STK463086
SMILES COC(=O)c1c(NC(=S)Nc2cccc(c2)O)sc(c1c1ccccc1)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 C20H18N2O3S2 MW 398.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O3S2/c1-12-16(13-7-4-3-5-8-13)17(19(24)25-2)18(27-12)22-20(26)21-14-9-6-10-15(23)11-14/h3-11,23H,1-2H3,(H2,21,22,26)InChIKey
GNEGGHCFQRNSCM-UHFFFAOYSA-NSynonyms
CC1=C(C(=C(S1)NC(=S)NC2=CC(=CC=C2)O)C(=O)OC)C3=CC=CC=C3
InChI=1SC20H18N2O3S2c11216(137435813)17(19(24)252)18(2712)2220(26)2114961015(23)1114h31123H12H3(H2212226)
METHYL2((((3HYDROXYPHENYL)AMINO)THIOXOMETHYL)AMINO)5METHYL4PHENYLTHIOPHENE3CARBOXYLATE
methyl2(((3hydroxyphenyl)carbamothioyl)amino)5methyl4phenylthiophene3carboxylate
methyl2((3hydroxyphenyl)carbamothioylamino)5methyl4phenylthiophene3carboxylate
MFCD06757566
ZINC000017081542
ZINC17081542
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