Vitas-M small molecule compound
N-[4-(butan-2-yl)phenyl]-2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide
Catalog ID
STK766500
SMILES CCC(c1ccc(cc1)NC(=O)CSc1nnc2c(n1)n(CCc1ccccc1)c1c2cccc1)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 C29H29N5OS MW 495.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N5OS/c1-3-20(2)22-13-15-23(16-14-22)30-26(35)19-36-29-31-28-27(32-33-29)24-11-7-8-12-25(24)34(28)18-17-21-9-5-4-6-10-21/h4-16,20H,3,17-19H2,1-2H3,(H,30,35)InChIKey
WPIBQKLFCONNPK-UHFFFAOYSA-NSynonyms
CCC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C4=CC=CC=C4N3CCC5=CC=CC=C5)N=N2
InChI=1SC29H29N5OSc1320(2)22131523(161422)3026(35)193629312827(323329)2411781225(24)34(28)18172195461021h41620H31719H212H3(H3035)
MFCD03017758
N(4(butan2yl)phenyl)2((5(2phenylethyl)5H(124)triazino(56b)indol3yl)sulfanyl)acetamide
N(4butan2ylphenyl)2((5(2phenylethyl)(124)triazino(56b)indol3yl)sulfanyl)acetamide
N(4BUTAN2YLPHENYL)2((5PHENETHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETAMIDE
ZINC000002191650
ZINC000002191651
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