Vitas-M small molecule compound

(2E)-N-({4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl}carbamothioyl)-3-(4-methylphenyl)prop-2-enamide

Catalog ID
STL334440
SMILES COc1nccnc1NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)/C=C/c1ccc(cc1)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 C22H21N5O4S2 MW 483.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O4S2/c1-15-3-5-16(6-4-15)7-12-19(28)26-22(32)25-17-8-10-18(11-9-17)33(29,30)27-20-21(31-2)24-14-13-23-20/h3-14H,1-2H3,(H,23,27)(H2,25,26,28,32)/b12-7+
InChIKey
WIIJKRNWNCXGHN-KPKJPENVSA-N
Synonyms
331004-71-8
(2E)N((4((3methoxypyrazin2yl)sulfamoyl)phenyl)carbamothioyl)3(4methylphenyl)prop2enamide
(E)N((4((3METHOXYPYRAZIN2YL)SULFAMOYL)PHENYL)CARBAMOTHIOYL)3(4METHYLPHENYL)PROP2ENAMIDE
(E)N((4(N(3methoxypyrazin2yl)sulfamoyl)phenyl)carbamothioyl)3(ptolyl)acrylamide
331004718
CC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CN=C3OC
COc1nccnc1NS(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)C=Cc1ccc(cc1)C
InChI=1SC22H21N5O4S2c1153516(6415)71219(28)2622(32)251781018(11917)33(2930)272021(312)2414132320h314H12H3(H2327)(H225262832)b127+
MFCD00498922
ZINC000002206606
ZINC02206606
ZINC2206606

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Available files

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