Vitas-M small molecule compound
N-[(7S)-10-{[4-(4-benzylpiperazin-1-yl)-4-oxobutyl]amino}-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Catalog ID
STL542448
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)N2CCN(CC2)Cc2ccccc2)NC(=O)C)cc(c1OC)OC
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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 C36H44N4O6 MW 628.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H44N4O6/c1-24(41)38-29-14-12-26-21-32(44-2)35(45-3)36(46-4)34(26)27-13-15-30(31(42)22-28(27)29)37-16-8-11-33(43)40-19-17-39(18-20-40)23-25-9-6-5-7-10-25/h5-7,9-10,13,15,21-22,29H,8,11-12,14,16-20,23H2,1-4H3,(H,37,42)(H,38,41)/t29-/m0/s1InChIKey
VVCGRGQKWMWBRY-LJAQVGFWSA-NSynonyms
1574346-75-0(S)N(10((4(4benzylpiperazin1yl)4oxobutyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
~(N)((7~(S))10((4(4benzylpiperazin1yl)4oxobutyl)amino)123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1574346750
75491660
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)N2CCN(CC2)Cc2ccccc2)NC(=O)C)cc(c1OC)OC
InChI=1SC36H44N4O6c124(41)38291412262132(442)35(453)36(464)34(26)27131530(31(42)2228(27)29)371681133(43)40191739(182040)232596571025h579101315212229H8111214162023H214H3(H3742)(H3841)t29m0s1
N((7S)10((4(4benzylpiperazin1yl)4oxobutyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000108449202
ZINC108449202
Check stock
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Check stock on Vitas-MAvailable files
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