Vitas-M small molecule compound
N-({3-chloro-4-[4-(thiophen-2-ylcarbonyl)piperazin-1-yl]phenyl}carbamoyl)-2-methoxy-3-methylbenzenecarbothioamide
Catalog ID
STK336736
SMILES COc1c(C)cccc1C(=S)NC(=O)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 C25H25ClN4O3S2 MW 529.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN4O3S2/c1-16-5-3-6-18(22(16)33-2)23(34)28-25(32)27-17-8-9-20(19(26)15-17)29-10-12-30(13-11-29)24(31)21-7-4-14-35-21/h3-9,14-15H,10-13H2,1-2H3,(H2,27,28,32,34)InChIKey
OIPPALQTFWBVPT-UHFFFAOYSA-NSynonyms
1(3chloro4(4(thiophene2carbonyl)piperazin1yl)phenyl)3(2methoxy3methylbenzenecarbothioyl)urea
1(3CHLORO4(4(THIOPHENE2CARBONYL)PIPERAZIN1YL)PHENYL)3(2METHOXY3METHYLTHIOBENZOYL)UREA
CC1=CC=CC(=C1OC)C(=S)NC(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CS4)Cl
InChI=1SC25H25ClN4O3S2c11653618(22(16)332)23(34)2825(32)27178920(19(26)1517)29101230(131129)24(31)2174143521h391415H1013H212H3(H227283234)
MFCD09964671
N((3chloro4(4(thiophen2ylcarbonyl)piperazin1yl)phenyl)carbamoyl)2methoxy3methylbenzenecarbothioamide
ZINC000100019317
ZINC100019317
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