Vitas-M small molecule compound
methyl 2-[({2-[(5-methyl-4-phenylthiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK456860
SMILES COC(=O)c1c(NC(=S)NNC(=O)c2csc(c2c2ccccc2)C)sc2c1CCCC2
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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 C23H23N3O3S3 MW 485.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O3S3/c1-13-18(14-8-4-3-5-9-14)16(12-31-13)20(27)25-26-23(30)24-21-19(22(28)29-2)15-10-6-7-11-17(15)32-21/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,25,27)(H2,24,26,30)InChIKey
SHVXIVXYFBPYLW-UHFFFAOYSA-NSynonyms
CC1=C(C(=CS1)C(=O)NNC(=S)NC2=C(C3=C(S2)CCCC3)C(=O)OC)C4=CC=CC=C4
InChI=1SC23H23N3O3S3c11318(148435914)16(123113)20(27)252623(30)242119(22(28)292)1510671117(15)3221h358912H671011H212H3(H2527)(H2242630)
methyl2(((2((5methyl4phenylthiophen3yl)carbonyl)hydrazinyl)carbonothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(((5methyl4phenylthiophene3carbonyl)amino)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD04220208
ZINC000002852661
ZINC02852661
ZINC2852661
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