Vitas-M small molecule compound
(2Z)-2-[(3-{3-[(2,6-dimethylmorpholin-4-yl)sulfonyl]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene][1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK800537
SMILES CC1OC(C)CN(C1)S(=O)(=O)c1cccc(c1)c1nn(cc1/C=c/1\sc2n(c1=O)c1c(n2)cccc1)c1ccccc1
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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 C31H27N5O4S2 MW 597.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N5O4S2/c1-20-17-34(18-21(2)40-20)42(38,39)25-12-8-9-22(15-25)29-23(19-35(33-29)24-10-4-3-5-11-24)16-28-30(37)36-27-14-7-6-13-26(27)32-31(36)41-28/h3-16,19-21H,17-18H2,1-2H3/b28-16-InChIKey
LWQLGGYEBMEJFB-NTFVMDSBSA-NSynonyms
(2Z)2((3(3((26dimethylmorpholin4yl)sulfonyl)phenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(2Z)2((3(3(26DIMETHYLMORPHOLIN4YL)SULFONYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C3=NN(C=C3C=C4C(=O)N5C6=CC=CC=C6N=C5S4)C7=CC=CC=C7
CC1OC(C)CN(C1)S(=O)(=O)c1cccc(c1)c1nn(cc1C=c1sc2n(c1=O)c1c(n2)cccc1)c1ccccc1
InChI=1SC31H27N5O4S2c1201734(1821(2)4020)42(3839)25128922(1525)2923(1935(3329)24104351124)162830(37)362714761326(27)3231(36)4128h3161921H1718H212H3b2816
MFCD06315612
ZINC000097946710
ZINC000097946712
Check stock
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Check stock on Vitas-MAvailable files
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