Vitas-M small molecule compound
2-{(1E)-N-[N-(7-methoxy-4-methylquinazolin-2-yl)carbamimidoyl]ethanimidoyl}benzoic acid
Catalog ID
STK789768
SMILES COc1ccc2c(c1)nc(nc2C)NC(=N)/N=C(/c1ccccc1C(=O)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 C20H19N5O3 MW 377.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O3/c1-11(14-6-4-5-7-16(14)18(26)27)22-19(21)25-20-23-12(2)15-9-8-13(28-3)10-17(15)24-20/h4-10H,1-3H3,(H,26,27)(H2,21,23,24,25)/b22-11+InChIKey
JDXKSYFSSITHDY-SSDVNMTOSA-NSynonyms
332382-71-5(E)2(1((N(7methoxy4methylquinazolin2yl)carbamimidoyl)imino)ethyl)benzoicacid
2((1E)N(N(7methoxy4methylquinazolin2yl)carbamimidoyl)ethanimidoyl)benzoicacid
2((E)N((E)N(7methoxy4methylquinazolin2yl)carbamimidoyl)Cmethylcarbonimidoyl)benzoicacid
332382715
CC1=NC(=NC2=C1C=CC(=C2)OC)N=C(N)N=C(C)C3=CC=CC=C3C(=O)O
COc1ccc2c(c1)nc(nc2C)NC(=N)N=C(c1ccccc1C(=O)O)C
InChI=1SC20H19N5O3c111(14645716(14)18(26)27)2219(21)25202312(2)159813(283)1017(15)2420h410H13H3(H2627)(H221232425)b2211+
MFCD01950413
ZINC000004808254
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