Vitas-M small molecule compound
N-benzyl-2-[(6-{[4,6-di(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Catalog ID
STK115693
SMILES O=C(NCc1ccccc1)CSc1nc2c(s1)cc(cc2)Nc1nc(nc(n1)N1CCCC1)N1CCCC1
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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 C27H30N8OS2 MW 546.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N8OS2/c36-23(28-17-19-8-2-1-3-9-19)18-37-27-30-21-11-10-20(16-22(21)38-27)29-24-31-25(34-12-4-5-13-34)33-26(32-24)35-14-6-7-15-35/h1-3,8-11,16H,4-7,12-15,17-18H2,(H,28,36)(H,29,31,32,33)InChIKey
WKRLJPBFROHPMS-UHFFFAOYSA-NSynonyms
C1CCN(C1)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=C(S4)SCC(=O)NCC5=CC=CC=C5)N6CCCC6
InChI=1SC27H30N8OS2c3623(2817198213919)1837273021111020(1622(21)3827)29243125(3412451334)3326(3224)3514671535h1381116H4712151718H2(H2836)(H29313233)
MFCD02951556
NBENZYL2((6((46DI(PYRROLIDIN1YL)135TRIAZIN2YL)AMINO)13BENZOTHIAZOL2YL)SULFANYL)ACETAMIDE
NBENZYL2((6((46DIPYRROLIDIN1YL135TRIAZIN2YL)AMINO)13BENZOTHIAZOL2YL)SULFANYL)ACETAMIDE
NBENZYL2(6(46DI(PYRROLIDIN1YL)135TRIAZIN2YLAMINO)BENZO(D)THIAZOL2YLTHIO)ACETAMIDE
ZINC000064503663
ZINC64503663
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