Vitas-M small molecule compound
trans-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-4-[(4-oxoquinazolin-3(4H)-yl)methyl]cyclohexanecarboxamide
Catalog ID
STL539704
SMILES O=C([C@@H]1CC[C@H](CC1)Cn1cnc2c(c1=O)cccc2)NC[C@@H]1CCCN2[C@@H]1CCCC2
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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 C26H36N4O2 MW 436.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H36N4O2/c31-25(27-16-21-6-5-15-29-14-4-3-9-24(21)29)20-12-10-19(11-13-20)17-30-18-28-23-8-2-1-7-22(23)26(30)32/h1-2,7-8,18-21,24H,3-6,9-17H2,(H,27,31)/t19-,20-,21-,24+/m0/s1InChIKey
MDRVZJZQLWPFPS-IBPRQYQWSA-NSynonyms
(1r4S)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)4((4oxoquinazolin3(4H)yl)methyl)cyclohexanecarboxamide
InChI=1SC26H36N4O2c3125(2716216515291443924(21)29)20121019(111320)1730182823821722(23)26(30)32h1278182124H36917H2(H2731)t19202124+m0s1
O=C((C@@H)1CC(C@H)(CC1)Cn1cnc2c(c1=O)cccc2)NC(C@@H)1CCCN2(C@@H)1CCCC2
transN((1S9aR)octahydro2Hquinolizin1ylmethyl)4((4oxoquinazolin3(4H)yl)methyl)cyclohexanecarboxamide
ZINC000252517590
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