Vitas-M small molecule compound
ethyl 4-[(2-{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}butanoyl)amino]benzoate
Catalog ID
STK209077
SMILES CCOC(=O)c1ccc(cc1)NC(=O)C(Sc1nnc2c(n1)n(CC=C)c1c2cccc1)CC
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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 C25H25N5O3S MW 475.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O3S/c1-4-15-30-19-10-8-7-9-18(19)21-22(30)27-25(29-28-21)34-20(5-2)23(31)26-17-13-11-16(12-14-17)24(32)33-6-3/h4,7-14,20H,1,5-6,15H2,2-3H3,(H,26,31)InChIKey
KDWLCQBXGFPBOL-UHFFFAOYSA-NSynonyms
775299-02-0775299020
CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)SC2=NC3=C(C4=CC=CC=C4N3CC=C)N=N2
ETHYL4((2((5(PROP2EN1YL)5H(124)TRIAZINO(56B)INDOL3YL)SULFANYL)BUTANOYL)AMINO)BENZOATE
ETHYL4(2((5PROP2ENYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)BUTANOYLAMINO)BENZOATE
InChI=1SC25H25N5O3Sc141530191087918(19)2122(30)2725(292821)3420(52)23(31)2617131116(121417)24(32)3363h471420H15615H223H3(H2631)
MFCD07081814
ZINC000003656476
ZINC000003656477
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