Vitas-M small molecule compound

tert-butyl [(4-{[4-(1H-indol-3-yl)-3,6-dihydropyridin-1(2H)-yl]carbonyl}cyclohexyl)methyl]carbamate

Catalog ID
STL471806
SMILES O=C(OC(C)(C)C)NCC1CCC(CC1)C(=O)N1CCC(=CC1)c1c[nH]c2c1cccc2

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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 C26H35N3O3 MW 437.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H35N3O3/c1-26(2,3)32-25(31)28-16-18-8-10-20(11-9-18)24(30)29-14-12-19(13-15-29)22-17-27-23-7-5-4-6-21(22)23/h4-7,12,17-18,20,27H,8-11,13-16H2,1-3H3,(H,28,31)
InChIKey
CGYUBYWOEBZTLZ-UHFFFAOYSA-N
Synonyms
1374525-60-6
1374525606
CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)N2CCC(=CC2)C3=CNC4=CC=CC=C43
InChI=1SC26H35N3O3c126(23)3225(31)28161881020(11918)24(30)29141219(131529)22172723754621(22)23h471217182027H8111316H213H3(H2831)
MFCD31751182
O=C(OC(C)(C)C)NC(C@@H)1CC(C@H)(CC1)C(=O)N1CCC(=CC1)c1c(nH)c2c1cccc2
O=C(OC(C)(C)C)NCC1CCC(CC1)C(=O)N1CCC(=CC1)c1c(nH)c2c1cccc2
tertbutyl(((1r4r)4(4(1Hindol3yl)1236tetrahydropyridine1carbonyl)cyclohexyl)methyl)carbamate
tertbutyl((4((4(1Hindol3yl)36dihydropyridin1(2H)yl)carbonyl)cyclohexyl)methyl)carbamate
tertbutylN((4(4(1Hindol3yl)36dihydro2Hpyridine1carbonyl)cyclohexyl)methyl)carbamate
ZINC000072326243
ZINC100796148

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.