Vitas-M small molecule compound
4-[(Z)-(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]phenyl (2E)-3-(4-tert-butylphenyl)prop-2-enoate
Catalog ID
STK701622
SMILES N=C1NC(=O)/C(=C/c2ccc(cc2)OC(=O)/C=C/c2ccc(cc2)C(C)(C)C)/S1
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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 C23H22N2O3S MW 406.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O3S/c1-23(2,3)17-9-4-15(5-10-17)8-13-20(26)28-18-11-6-16(7-12-18)14-19-21(27)25-22(24)29-19/h4-14H,1-3H3,(H2,24,25,27)/b13-8+,19-14-InChIKey
QOIFDBXJJMGWRX-ILPOUQNUSA-NSynonyms
(4((Z)(2AMINO4OXO13THIAZOL5YLIDENE)METHYL)PHENYL)(E)3(4TERTBUTYLPHENYL)PROP2ENOATE
4((Z)(2imino4oxo13thiazolidin5ylidene)methyl)phenyl(2E)3(4tertbutylphenyl)prop2enoate
CC(C)(C)C1=CC=C(C=C1)C=CC(=O)OC2=CC=C(C=C2)C=C3C(=O)N=C(S3)N
InChI=1SC23H22N2O3Sc123(23)179415(51017)81320(26)281811616(71218)141921(27)2522(24)2919h414H13H3(H2242527)b138+1914
MFCD03461557
N=C1NC(=O)C(=Cc2ccc(cc2)OC(=O)C=Cc2ccc(cc2)C(C)(C)C)S1
ZINC000003852219
ZINC03852219
ZINC24302996
ZINC3852219
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