Vitas-M small molecule compound
3-{2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-oxoethyl}-4,8,8-trimethyl-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-2-one
Catalog ID
STK624744
SMILES O=C(N1CCC(CC1)c1nc2c([nH]1)cccc2)Cc1c(=O)oc2c(c1C)cc1c(c2)OC(CC1)(C)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 C29H31N3O4 MW 485.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O4/c1-17-20-14-19-8-11-29(2,3)36-24(19)16-25(20)35-28(34)21(17)15-26(33)32-12-9-18(10-13-32)27-30-22-6-4-5-7-23(22)31-27/h4-7,14,16,18H,8-13,15H2,1-3H3,(H,30,31)InChIKey
PYOTUAODJVYRFU-UHFFFAOYSA-NSynonyms
939897-78-63(2(4(1Hbenzimidazol2yl)piperidin1yl)2oxoethyl)488trimethyl78dihydro2H6Hpyrano(32g)chromen2one
3(2(4(1Hbenzo(d)imidazol2yl)piperidin1yl)2oxoethyl)488trimethyl78dihydropyrano(32g)chromen2(6H)one
7(2(4(1Hbenzimidazol2yl)piperidin1yl)2oxoethyl)226trimethyl34dihydropyrano(32g)chromen8one
939897786
CC1=C(C(=O)OC2=CC3=C(CCC(O3)(C)C)C=C12)CC(=O)N4CCC(CC4)C5=NC6=CC=CC=C6N5
InChI=1SC29H31N3O4c11720141981129(23)3624(19)1625(20)3528(34)21(17)1526(33)3212918(101332)273022645723(22)3127h47141618H81315H213H3(H3031)
O=C(N1CCC(CC1)c1nc2c((nH)1)cccc2)Cc1c(=O)oc2c(c1C)cc1c(c2)OC(CC1)(C)C
ZINC000009060486
ZINC09060486
ZINC9060486
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