Vitas-M small molecule compound
2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-nitrophenyl)butanamide
Catalog ID
STK246733
SMILES CCC(C(=O)Nc1ccc(cc1)[N+](=O)[O-])Sc1nnc2c(n1)n(C)c1c2cccc1
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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 C20H18N6O3S MW 422.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N6O3S/c1-3-16(19(27)21-12-8-10-13(11-9-12)26(28)29)30-20-22-18-17(23-24-20)14-6-4-5-7-15(14)25(18)2/h4-11,16H,3H2,1-2H3,(H,21,27)InChIKey
VVZQLOQVPSWDPU-UHFFFAOYSA-NSynonyms
404914-78-92((5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)N(4NITROPHENYL)BUTANAMIDE
2((5METHYL5H(124)TRIAZINO(56B)INDOL3YL)SULFANYL)N(4NITROPHENYL)BUTANAMIDE
404914789
CCC(C(=O)NC1=CC=C(C=C1)(N+)(=O)(O))SC2=NC3=C(C4=CC=CC=C4N3C)N=N2
CCC(C(=O)Nc1ccc(cc1)(N+)(=O)(O))Sc1nnc2c(n1)n(C)c1c2cccc1
InChI=1SC20H18N6O3Sc1316(19(27)211281013(11912)26(28)29)3020221817(232420)14645715(14)25(18)2h41116H3H212H3(H2127)
MFCD02221861
ZINC000008441619
ZINC000008441620
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