Vitas-M small molecule compound
2-{[(2Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL331357
SMILES N#C/C(=C/c1ccc(cc1)OC)/C(=O)Nc1sc2c(c1C(=O)N)CCC(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 C21H21N3O3S MW 395.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3S/c1-12-3-8-16-17(9-12)28-21(18(16)19(23)25)24-20(26)14(11-22)10-13-4-6-15(27-2)7-5-13/h4-7,10,12H,3,8-9H2,1-2H3,(H2,23,25)(H,24,26)/b14-10-InChIKey
TXCDZICBWXZKTM-UVTDQMKNSA-NSynonyms
307539-32-8(Z)2(2cyano3(4methoxyphenyl)acrylamido)6methyl4567tetrahydrobenzo(b)thiophene3carboxamide
2(((2Z)2cyano3(4methoxyphenyl)prop2enoyl)amino)6methyl4567tetrahydro1benzothiophene3carboxamide
2(((Z)2cyano3(4methoxyphenyl)prop2enoyl)amino)6methyl4567tetrahydro1benzothiophene3carboxamide
307539328
CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C(=CC3=CC=C(C=C3)OC)C#N
InChI=1SC21H21N3O3Sc112381617(912)2821(18(16)19(23)25)2420(26)14(1122)10134615(272)7513h471012H389H212H3(H22325)(H2426)b1410
MFCD02999659
N#CC(=Cc1ccc(cc1)OC)C(=O)Nc1sc2c(c1C(=O)N)CCC(C2)C
ZINC000013532921
ZINC000013532926
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