Vitas-M small molecule compound
1-{(E)-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-phenylthiourea
Catalog ID
STL090259
SMILES Clc1ccc2c(c1)c(CCN/C(=N\C(=S)Nc1ccccc1)/Nc1nc(C)cc(n1)C)c[nH]2
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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 C24H24ClN7S MW 478.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24ClN7S/c1-15-12-16(2)29-23(28-15)31-22(32-24(33)30-19-6-4-3-5-7-19)26-11-10-17-14-27-21-9-8-18(25)13-20(17)21/h3-9,12-14,27H,10-11H2,1-2H3,(H3,26,28,29,30,31,32,33)InChIKey
KHGPHNIRJLPNEQ-UHFFFAOYSA-NSynonyms
1((E)((2(5chloro1Hindol3yl)ethyl)amino)((46dimethylpyrimidin2yl)amino)methylidene)3phenylthiourea
1(N(2(5chloro1Hindol3yl)ethyl)N(46dimethylpyrimidin2yl)carbamimidoyl)3phenylthiourea
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)Cl)NC(=S)NC4=CC=CC=C4)C
Clc1ccc2c(c1)c(CCNC(=NC(=S)Nc1ccccc1)Nc1nc(C)cc(n1)C)c(nH)2
InChI=1SC24H24ClN7Sc1151216(2)2923(2815)3122(3224(33)30196435719)261110171427219818(25)1320(17)21h39121427H1011H212H3(H326282930313233)
MFCD08709313
ZINC000014729897
ZINC14729897
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