Vitas-M small molecule compound

(3S)-2-({1-[1-(tert-butoxycarbonyl)-L-prolyl]-4-phenylpiperidin-4-yl}carbonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

Catalog ID
STK598635
SMILES O=C([C@@H]1CCCN1C(=O)OC(C)(C)C)N1CCC(CC1)(c1ccccc1)C(=O)N1Cc2ccccc2C[C@H]1C(=O)O

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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 C32H39N3O6 MW 561.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H39N3O6/c1-31(2,3)41-30(40)34-17-9-14-25(34)27(36)33-18-15-32(16-19-33,24-12-5-4-6-13-24)29(39)35-21-23-11-8-7-10-22(23)20-26(35)28(37)38/h4-8,10-13,25-26H,9,14-21H2,1-3H3,(H,37,38)/t25-,26-/m0/s1
InChIKey
FWWGPNQXFHKYAI-UIOOFZCWSA-N
Synonyms
1212729-43-5
(3S)2((1(1(tertbutoxycarbonyl)Lprolyl)4phenylpiperidin4yl)carbonyl)1234tetrahydroisoquinoline3carboxylicacid
(3S)2(1((2S)1((2methylpropan2yl)oxycarbonyl)pyrrolidine2carbonyl)4phenylpiperidine4carbonyl)34dihydro1Hisoquinoline3carboxylicacid
(S)2(1((S)1(tertbutoxycarbonyl)pyrrolidine2carbonyl)4phenylpiperidine4carbonyl)1234tetrahydroisoquinoline3carboxylicacid
1212729435
CC(C)(C)OC(=O)N1CCCC1C(=O)N2CCC(CC2)(C3=CC=CC=C3)C(=O)N4CC5=CC=CC=C5CC4C(=O)O
InChI=1SC32H39N3O6c131(23)4130(40)341791425(34)27(36)33181532(16193324125461324)29(39)35212311871022(23)2026(35)28(37)38h4810132526H91421H213H3(H3738)t2526m0s1
MFCD07211123
O=C((C@@H)1CCCN1C(=O)OC(C)(C)C)N1CCC(CC1)(c1ccccc1)C(=O)N1Cc2ccccc2C(C@H)1C(=O)O
ZINC000101669671
ZINC101669671

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Available files

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