Vitas-M small molecule compound
methyl 3-chloro-6-[(1,4-dioxa-8-azaspiro[4.5]dec-8-ylcarbonothioyl)amino]-1-benzothiophene-2-carboxylate
Catalog ID
STK457599
SMILES COC(=O)c1sc2c(c1Cl)ccc(c2)NC(=S)N1CCC2(CC1)OCCO2
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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 C18H19ClN2O4S2 MW 426.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN2O4S2/c1-23-16(22)15-14(19)12-3-2-11(10-13(12)27-15)20-17(26)21-6-4-18(5-7-21)24-8-9-25-18/h2-3,10H,4-9H2,1H3,(H,20,26)InChIKey
WZEKQMCLIRCYQP-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=S)N3CCC4(CC3)OCCO4)Cl
InChI=1SC18H19ClN2O4S2c12316(22)1514(19)123211(1013(12)2715)2017(26)216418(5721)24892518h2310H49H21H3(H2026)
methyl3chloro6((14dioxa8azaspiro(45)dec8ylcarbonothioyl)amino)1benzothiophene2carboxylate
METHYL3CHLORO6(14DIOXA8AZASPIRO(45)DECANE8CARBOTHIOYLAMINO)1BENZOTHIOPHENE2CARBOXYLATE
METHYL6(((14DIOXA8AZASPIRO(45)DEC8YL)THIOXOMETHYL)AMINO)3CHLOROBENZO(B)THIOPHENE2CARBOXYLATE
MFCD04137325
ZINC000001121875
ZINC01121875
ZINC1121875
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