Vitas-M small molecule compound
methyl 5-benzyl-2-[({2-[(3-chloro-6-nitro-1-benzothiophen-2-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate
Catalog ID
STK491558
SMILES COC(=O)c1cc(sc1NC(=S)NNC(=O)c1sc2c(c1Cl)ccc(c2)[N+](=O)[O-])Cc1ccccc1
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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 C23H17ClN4O5S3 MW 561.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN4O5S3/c1-33-22(30)16-11-14(9-12-5-3-2-4-6-12)35-21(16)25-23(34)27-26-20(29)19-18(24)15-8-7-13(28(31)32)10-17(15)36-19/h2-8,10-11H,9H2,1H3,(H,26,29)(H2,25,27,34)InChIKey
IWODTVCJQCNTDU-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NNC(=O)C3=C(C4=C(S3)C=C(C=C4)(N+)(=O)(O))Cl
COC(=O)c1cc(sc1NC(=S)NNC(=O)c1sc2c(c1Cl)ccc(c2)(N+)(=O)(O))Cc1ccccc1
InChI=1SC23H17ClN4O5S3c13322(30)161114(9125324612)3521(16)2523(34)272620(29)1918(24)158713(28(31)32)1017(15)3619h281011H9H21H3(H2629)(H2252734)
METHYL2(((((3CHLORO6NITROBENZO(B)THIOPHEN2YL)CARBONYLAMINO)AMINO)THIOXOMETHYL)AMINO)5BENZYLTHIOPHENE3CARBOXYLATE
methyl5benzyl2(((2((3chloro6nitro1benzothiophen2yl)carbonyl)hydrazinyl)carbonothioyl)amino)thiophene3carboxylate
methyl5benzyl2(((3chloro6nitro1benzothiophene2carbonyl)amino)carbamothioylamino)thiophene3carboxylate
MFCD04264491
ZINC000102378370
ZINC102378370
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Check stock on Vitas-MAvailable files
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