Vitas-M small molecule compound
(1E)-N-[(7-benzyl-8,9-diphenyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]-1-(3,4-dimethoxyphenyl)ethanimine
Catalog ID
STK725555
SMILES COc1ccc(cc1OC)/C(=N/OCc1nc2n(n1)cnc1c2c(c2ccccc2)c(n1Cc1ccccc1)c1ccccc1)/C
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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 C37H32N6O3 MW 608.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H32N6O3/c1-25(29-19-20-30(44-2)31(21-29)45-3)41-46-23-32-39-37-34-33(27-15-9-5-10-16-27)35(28-17-11-6-12-18-28)42(22-26-13-7-4-8-14-26)36(34)38-24-43(37)40-32/h4-21,24H,22-23H2,1-3H3/b41-25+InChIKey
YNAMQNXRJJFQSB-UACWCTJZSA-NSynonyms
(1E)N((7benzyl89diphenyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)1(34dimethoxyphenyl)ethanimine
(E)1(34dimethoxyphenyl)ethanoneO((7benzyl89diphenyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
CC(=NOCC1=NN2C=NC3=C(C2=N1)C(=C(N3CC4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C7=CC(=C(C=C7)OC)OC
COc1ccc(cc1OC)C(=NOCc1nc2n(n1)cnc1c2c(c2ccccc2)c(n1Cc1ccccc1)c1ccccc1)C
InChI=1SC37H32N6O3c125(29192030(442)31(2129)453)4146233239373433(271595101627)35(2817116121828)42(2226137481426)36(34)382443(37)4032h42124H2223H213H3b4125+
MFCD03678538
ZINC000097968548
ZINC102647371
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