Vitas-M small molecule compound

N~2~-{[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]acetyl}-N~2~-(furan-2-ylmethyl)-N-tricyclo[3.3.1.1~3,7~]dec-1-ylglycinamide

Catalog ID
STL439348
SMILES O=C(NC12CC3CC(C2)CC(C1)C3)CN(C(=O)CC1C(C1(C)C)c1c(C)[nH]c2c1cccc2)Cc1ccco1

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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 C33H41N3O3 MW 527.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H41N3O3/c1-20-30(25-8-4-5-9-27(25)34-20)31-26(32(31,2)3)14-29(38)36(18-24-7-6-10-39-24)19-28(37)35-33-15-21-11-22(16-33)13-23(12-21)17-33/h4-10,21-23,26,31,34H,11-19H2,1-3H3,(H,35,37)
InChIKey
YBMSSMHAVYUCJA-UHFFFAOYSA-N
Synonyms

CC1=C(C2=CC=CC=C2N1)C3C(C3(C)C)CC(=O)N(CC4=CC=CO4)CC(=O)NC56CC7CC(C5)CC(C7)C6
InChI=1SC33H41N3O3c12030(25845927(25)3420)3126(32(312)3)1429(38)36(182476103924)1928(37)353315211122(1633)1323(1221)1733h4102123263134H1119H213H3(H3537)
N(2(1ADAMANTYLAMINO)2OXOETHYL)2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)N(FURAN2YLMETHYL)ACETAMIDE
N~2~((22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)N~2~(furan2ylmethyl)Ntricyclo(3311~37~)dec1ylglycinamide
O=C(NC12CC3CC(C2)CC(C1)C3)CN(C(=O)CC1C(C1(C)C)c1c(C)(nH)c2c1cccc2)Cc1ccco1
ZINC000008748991
ZINC000016949613

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Available files

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