Vitas-M small molecule compound
ethyl 4-{[(4'-carbamoyl-1,4'-bipiperidin-1'-yl)carbonothioyl]amino}benzoate
Catalog ID
STK082540
SMILES CCOC(=O)c1ccc(cc1)NC(=S)N1CCC(CC1)(C(=O)N)N1CCCCC1
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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 C21H30N4O3S MW 418.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N4O3S/c1-2-28-18(26)16-6-8-17(9-7-16)23-20(29)24-14-10-21(11-15-24,19(22)27)25-12-4-3-5-13-25/h6-9H,2-5,10-15H2,1H3,(H2,22,27)(H,23,29)InChIKey
RGCLMSHSTOWZPE-UHFFFAOYSA-NSynonyms
433255-44-8433255448
CCOC(=O)C1=CC=C(C=C1)NC(=S)N2CCC(CC2)(C(=O)N)N3CCCCC3
CCOC(=O)c1ccc(cc1)NC(=S)N1CCC(CC1)(C(=O)N)N1CCCCC1
ETHYL4(((4CARBAMOYL14BIPIPERIDIN1YL)CARBONOTHIOYL)AMINO)BENZOATE
ETHYL4(((4CARBAMOYL4PIPERIDYLPIPERIDYL)THIOXOMETHYL)AMINO)BENZOATE
ETHYL4((4CARBAMOYL4PIPERIDIN1YLPIPERIDINE1CARBOTHIOYL)AMINO)BENZOATE
ethyl4(4carbamoyl(14bipiperidine)1carbothioamido)benzoate
InChI=1SC21H30N4O3Sc122818(26)166817(9716)2320(29)24141021(11152419(22)27)25124351325h69H251015H21H3(H22227)(H2329)
MFCD03170602
STK082540
ZINC000000787383
ZINC787383
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