Vitas-M small molecule compound
3-[({[4-(butan-2-yloxy)phenyl]carbonyl}carbamothioyl)amino]-2-methylbenzoic acid
Catalog ID
STK106489
SMILES CCC(Oc1ccc(cc1)C(=O)NC(=S)Nc1cccc(c1C)C(=O)O)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 C20H22N2O4S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4S/c1-4-12(2)26-15-10-8-14(9-11-15)18(23)22-20(27)21-17-7-5-6-16(13(17)3)19(24)25/h5-12H,4H2,1-3H3,(H,24,25)(H2,21,22,23,27)InChIKey
PDTYWANHNYVVGY-UHFFFAOYSA-NSynonyms
532978-79-33((((4(BUTAN2YLOXY)PHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)2METHYLBENZOICACID
3(((4((2R)BUTAN2YLOXY)BENZOYL)CARBAMOTHIOYL)AMINO)2METHYLBENZOICACID
3((4BUTAN2YLOXYBENZOYL)CARBAMOTHIOYLAMINO)2METHYLBENZOICACID
532978793
BENZOICACID2METHYL3((((4(1METHYLPROPOXY)BENZOYL)AMINO)THIOXOMETHYL)AMINO)
CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2C)C(=O)O
InChI=1SC20H22N2O4Sc1412(2)261510814(91115)18(23)2220(27)211775616(13(17)3)19(24)25h512H4H213H3(H2425)(H221222327)
MFCD03570556
ZINC000001125623
ZINC000001125625
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