Vitas-M small molecule compound
methyl 2-({[2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonyl)hydrazinyl]carbonothioyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK455650
SMILES COC(=O)c1c(NC(=S)NNC(=O)c2cc3c(s2)CCCCC3)sc2c1CCC2
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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 C20H23N3O3S3 MW 449.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O3S3/c1-26-19(25)16-12-7-5-9-14(12)29-18(16)21-20(27)23-22-17(24)15-10-11-6-3-2-4-8-13(11)28-15/h10H,2-9H2,1H3,(H,22,24)(H2,21,23,27)InChIKey
KXCZXWMJEGQMES-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCC2)NC(=S)NNC(=O)C3=CC4=C(S3)CCCCC4
InChI=1SC20H23N3O3S3c12619(25)161275914(12)2918(16)2120(27)232217(24)1510116324813(11)2815h10H29H21H3(H2224)(H2212327)
methyl2(((2(5678tetrahydro4Hcyclohepta(b)thiophen2ylcarbonyl)hydrazinyl)carbonothioyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
methyl2((5678tetrahydro4Hcyclohepta(b)thiophene2carbonylamino)carbamothioylamino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
MFCD04228575
ZINC000020220658
ZINC20220658
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