Vitas-M small molecule compound
N-[(2-{4-[(4-chlorophenyl)carbonyl]piperazin-1-yl}phenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Catalog ID
STK253848
SMILES Clc1ccc(cc1)C(=O)N1CCN(CC1)c1ccccc1NC(=S)NC(=O)c1ccc2c(c1)OCCO2
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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 C27H25ClN4O4S MW 537.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClN4O4S/c28-20-8-5-18(6-9-20)26(34)32-13-11-31(12-14-32)22-4-2-1-3-21(22)29-27(37)30-25(33)19-7-10-23-24(17-19)36-16-15-35-23/h1-10,17H,11-16H2,(H2,29,30,33,37)InChIKey
IYDGECDJGHUPNK-UHFFFAOYSA-NSynonyms
2H3HBENZO(34E)14DIOXAN6YLN(((2(4((4CHLOROPHENYL)CARBONYL)PIPERAZINYL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
C1CN(CCN1C2=CC=CC=C2NC(=S)NC(=O)C3=CC4=C(C=C3)OCCO4)C(=O)C5=CC=C(C=C5)Cl
InChI=1SC27H25ClN4O4Sc28208518(6920)26(34)32131131(121432)22421321(22)2927(37)3025(33)197102324(1719)3616153523h11017H1116H2(H229303337)
MFCD04966610
N((2(4((4chlorophenyl)carbonyl)piperazin1yl)phenyl)carbamothioyl)23dihydro14benzodioxine6carboxamide
N((2(4(4CHLOROBENZOYL)PIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)23DIHYDRO14BENZODIOXINE6CARBOXAMIDE
ZINC000004122793
ZINC4122793
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