Vitas-M small molecule compound
methyl N-({[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetyl)valinate
Catalog ID
STK125979
SMILES C=CCn1c2ccccc2c2c1nc(SCC(=O)NC(C(=O)OC)C(C)C)nn2
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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 C20H23N5O3S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O3S/c1-5-10-25-14-9-7-6-8-13(14)17-18(25)22-20(24-23-17)29-11-15(26)21-16(12(2)3)19(27)28-4/h5-9,12,16H,1,10-11H2,2-4H3,(H,21,26)InChIKey
SYKGCJIGRJXLTP-UHFFFAOYSA-NSynonyms
CC(C)C(C(=O)OC)NC(=O)CSC1=NC2=C(C3=CC=CC=C3N2CC=C)N=N1
InChI=1SC20H23N5O3Sc15102514976813(14)1718(25)2220(242317)291115(26)2116(12(2)3)19(27)284h591216H11011H224H3(H2126)
METHYL3METHYL2((2((5PROP2ENYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)BUTANOATE
METHYLN(((5(PROP2EN1YL)5H(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)VALINATE
MFCD04128749
ZINC000002481305
ZINC000002481306
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