Vitas-M small molecule compound
3-butoxy-N-({3-chloro-4-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]phenyl}carbamothioyl)benzamide
Catalog ID
STK344906
SMILES CCCCOc1cccc(c1)C(=O)NC(=S)Nc1ccc(c(c1)Cl)N1CCN(CC1)C(=O)c1cccs1
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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 C27H29ClN4O3S2 MW 557.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29ClN4O3S2/c1-2-3-15-35-21-7-4-6-19(17-21)25(33)30-27(36)29-20-9-10-23(22(28)18-20)31-11-13-32(14-12-31)26(34)24-8-5-16-37-24/h4-10,16-18H,2-3,11-15H2,1H3,(H2,29,30,33,36)InChIKey
ZBJOCZREQGDDIC-UHFFFAOYSA-NSynonyms
1(3BUTOXYBENZOYL)3(3CHLORO4(4(THIOPHENE2CARBONYL)PIPERAZIN1YL)PHENYL)THIOUREA
3butoxyN((3chloro4(4(thiophen2ylcarbonyl)piperazin1yl)phenyl)carbamothioyl)benzamide
3butoxyN((3chloro4(4(thiophene2carbonyl)piperazin1yl)phenyl)carbamothioyl)benzamide
CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CS4)Cl
InChI=1SC27H29ClN4O3S2c12315352174619(1721)25(33)3027(36)292091023(22(28)1820)31111332(141231)26(34)2485163724h4101618H231115H21H3(H229303336)
MFCD07148510
ZINC000097948204
ZINC97948204
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