Vitas-M small molecule compound
2-({(Z)-[1-(4-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-1,3-benzothiazol-6-yl thiocyanate
Catalog ID
STL174242
SMILES N#CSc1ccc2c(c1)sc(n2)N/C=C\1/C(=O)NC(=O)N(C1=O)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 C20H13N5O3S2 MW 435.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N5O3S2/c1-11-2-4-12(5-3-11)25-18(27)14(17(26)24-20(25)28)9-22-19-23-15-7-6-13(29-10-21)8-16(15)30-19/h2-9H,1H3,(H,22,23)(H,24,26,28)/b14-9-InChIKey
QAHLVZFYOVGVSU-ZROIWOOFSA-NSynonyms
495375-85-4(2(((Z)(1(4METHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)AMINO)13BENZOTHIAZOL6YL)THIOCYANATE
2(((Z)(1(4methylphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)amino)13benzothiazol6ylthiocyanate
495375854
CC1=CC=C(C=C1)N2C(=O)C(=CNC3=NC4=C(S3)C=C(C=C4)SC#N)C(=O)NC2=O
InChI=1SC20H13N5O3S2c1112412(5311)2518(27)14(17(26)2420(25)28)9221923157613(291021)816(15)3019h29H1H3(H2223)(H242628)b149
MFCD02606078
N#CSc1ccc2c(c1)sc(n2)NC=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)C
ZINC000013882168
ZINC13882168
Check stock
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