Vitas-M small molecule compound
5-(anthracen-9-ylmethyl)-1,3-dimethyl-5-{[(1R,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK529206
SMILES S=C1N(C)C(=O)C(C(=O)N1C)(CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1c2ccccc2cc2c1cccc2
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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 C33H32N4O3S MW 564.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32N4O3S/c1-34-30(39)33(31(40)35(2)32(34)41,16-27-25-10-5-3-8-22(25)15-23-9-4-6-11-26(23)27)20-36-17-21-14-24(19-36)28-12-7-13-29(38)37(28)18-21/h3-13,15,21,24H,14,16-20H2,1-2H3/t21-,24+/m0/s1InChIKey
MVPDGZMCGVDNHU-XUZZJYLKSA-NSynonyms
5(anthracen9ylmethyl)13dimethyl5(((1R5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)2thioxodihydropyrimidine46(1H5H)dione
5(anthracen9ylmethyl)13dimethyl5(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)2thioxodihydropyrimidine46(1H5H)dione
MFCD18241587
S=C1N(C)C(=O)C(C(=O)N1C)(CN1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)Cc1c2ccccc2cc2c1cccc2
S=C1N(C)C(=O)C(C(=O)N1C)(CN1C(C@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)Cc1c2ccccc2cc2c1cccc2
ZINC000102607616
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