Vitas-M small molecule compound
N-[(4-{4-[(2-methylphenyl)carbonyl]piperazin-1-yl}phenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Catalog ID
STK360164
SMILES S=C(NC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccccc1C
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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 C28H28N4O4S MW 516.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O4S/c1-19-4-2-3-5-23(19)27(34)32-14-12-31(13-15-32)22-9-7-21(8-10-22)29-28(37)30-26(33)20-6-11-24-25(18-20)36-17-16-35-24/h2-11,18H,12-17H2,1H3,(H2,29,30,33,37)InChIKey
GEFWFHYFEOLTPD-UHFFFAOYSA-NSynonyms
1(23DIHYDROBENZO(14)DIOXINE6CARBONYL)3(4(4(2METHYLBENZOYL)PIPERAZIN1YL)PHENYL)THIOUREA
CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC5=C(C=C4)OCCO5
InChI=1SC28H28N4O4Sc119423523(19)27(34)32141231(131532)229721(81022)2928(37)3026(33)206112425(1820)3617163524h21118H1217H21H3(H229303337)
MFCD03908377
N((4(4((2METHYLPHENYL)CARBONYL)PIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)23DIHYDRO14BENZODIOXINE6CARBOXAMIDE
N((4(4(2METHYLBENZOYL)PIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)23DIHYDRO14BENZODIOXINE6CARBOXAMIDE
ZINC000009886322
ZINC09886322
ZINC9886322
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