Vitas-M small molecule compound
ethyl 2-[(5Z)-2,4-dioxo-5-{[1-(prop-2-yn-1-yl)-1H-indol-3-yl]methylidene}-1,3-thiazolidin-3-yl]propanoate
Catalog ID
STK157401
SMILES CCOC(=O)C(N1C(=O)S/C(=C\c2cn(c3c2cccc3)CC#C)/C1=O)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 C20H18N2O4S MW 382.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O4S/c1-4-10-21-12-14(15-8-6-7-9-16(15)21)11-17-18(23)22(20(25)27-17)13(3)19(24)26-5-2/h1,6-9,11-13H,5,10H2,2-3H3/b17-11-InChIKey
ABBLQAZPRJSTDT-BOPFTXTBSA-NSynonyms
CCOC(=O)C(C)N1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC#C)SC1=O
CCOC(=O)C(N1C(=O)SC(=Cc2cn(c3c2cccc3)CC#C)C1=O)C
ETHYL2((5Z)24DIOXO5((1(PROP2YN1YL)1HINDOL3YL)METHYLIDENE)13THIAZOLIDIN3YL)PROPANOATE
ETHYL2((5Z)24DIOXO5((1PROP2YNYLINDOL3YL)METHYLIDENE)13THIAZOLIDIN3YL)PROPANOATE
InChI=1SC20H18N2O4Sc1410211214(15867916(15)21)111718(23)22(20(25)2717)13(3)19(24)2652h1691113H510H223H3b1711
MFCD03729428
ZINC000000981115
ZINC000000981117
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