Vitas-M small molecule compound
N-(2-chlorophenyl)-4-{2-[(2-methoxy-4-nitrophenyl)carbamothioyl]hydrazinyl}-4-oxobutanamide
Catalog ID
STK455472
SMILES COc1cc(ccc1NC(=S)NNC(=O)CCC(=O)Nc1ccccc1Cl)[N+](=O)[O-]
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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 C18H18ClN5O5S MW 451.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN5O5S/c1-29-15-10-11(24(27)28)6-7-14(15)21-18(30)23-22-17(26)9-8-16(25)20-13-5-3-2-4-12(13)19/h2-7,10H,8-9H2,1H3,(H,20,25)(H,22,26)(H2,21,23,30)InChIKey
IFCVNIZISSOMNT-UHFFFAOYSA-NSynonyms
COC1=C(C=CC(=C1)(N+)(=O)(O))NC(=S)NNC(=O)CCC(=O)NC2=CC=CC=C2Cl
COc1cc(ccc1NC(=S)NNC(=O)CCC(=O)Nc1ccccc1Cl)(N+)(=O)(O)
InChI=1SC18H18ClN5O5Sc129151011(24(27)28)6714(15)2118(30)232217(26)9816(25)2013532412(13)19h2710H89H21H3(H2025)(H2226)(H2212330)
MFCD04227694
N(2chlorophenyl)4(2((2methoxy4nitrophenyl)carbamothioyl)hydrazinyl)4oxobutanamide
N(2CHLOROPHENYL)N((((2METHOXY4NITROPHENYL)AMINO)THIOXOMETHYL)AMINO)BUTANE14DIAMIDE
ZINC000015899657
ZINC15899657
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