Vitas-M small molecule compound
(E)-N-{[10-methyl-11-(4-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}-1-phenylmethanimine
Catalog ID
STK574804
SMILES Cc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CO/N=C/c1ccccc1)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 C31H25N7O2 MW 527.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25N7O2/c1-20-13-15-23(16-14-20)27-26-21(2)35-38(24-11-7-4-8-12-24)31(26)40-30-28(27)29-34-25(36-37(29)19-32-30)18-39-33-17-22-9-5-3-6-10-22/h3-17,19,27H,18H2,1-2H3/b33-17+InChIKey
DBIROYAQQCZYOU-ATZGPIRCSA-NSynonyms
900896-46-0(E)benzaldehydeO((10methyl8phenyl11(ptolyl)811dihydropyrazolo(4356)pyrano(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
(E)N((10methyl11(4methylphenyl)8phenyl811dihydropyrazolo(4356)pyrano(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)1phenylmethanimine
900896460
CC1=CC=C(C=C1)C2C3=C(N(N=C3C)C4=CC=CC=C4)OC5=C2C6=NC(=NN6C=N5)CON=CC7=CC=CC=C7
Cc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CON=Cc1ccccc1)c1ccccc1
InChI=1SC31H25N7O2c120131523(161420)272621(2)3538(24117481224)31(26)403028(27)293425(3637(29)193230)183933172295361022h3171927H18H212H3b3317+
MFCD06778465
ZINC000101335551
ZINC000101335554
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