Vitas-M small molecule compound
methyl 6-methyl-2-{[(4-sulfamoylbenzyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK456810
SMILES COC(=O)c1c(NC(=S)NCc2ccc(cc2)S(=O)(=O)N)sc2c1CCC(C2)C
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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 C19H23N3O4S3 MW 453.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O4S3/c1-11-3-8-14-15(9-11)28-17(16(14)18(23)26-2)22-19(27)21-10-12-4-6-13(7-5-12)29(20,24)25/h4-7,11H,3,8-10H2,1-2H3,(H2,20,24,25)(H2,21,22,27)InChIKey
KHJGBJSULKASSK-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=S)NCC3=CC=C(C=C3)S(=O)(=O)N
InChI=1SC19H23N3O4S3c111381415(911)2817(16(14)18(23)262)2219(27)2110124613(7512)29(2024)25h4711H3810H212H3(H2202425)(H2212227)
methyl6methyl2(((4sulfamoylbenzyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6methyl2((4sulfamoylphenyl)methylcarbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD04136881
ZINC000002857153
ZINC000002857154
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