Vitas-M small molecule compound

6,7-dimethoxy-N-[(2S)-3-methyl-1-oxo-1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)butan-2-yl]-3,4-dihydroisoquinoline-2(1H)-carboxamide

Catalog ID
STK621415
SMILES COc1cc2CN(CCc2cc1OC)C(=O)N[C@H](C(=O)NC1CCCc2c1cccc2)C(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 C27H35N3O4 MW 465.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35N3O4/c1-17(2)25(26(31)28-22-11-7-9-18-8-5-6-10-21(18)22)29-27(32)30-13-12-19-14-23(33-3)24(34-4)15-20(19)16-30/h5-6,8,10,14-15,17,22,25H,7,9,11-13,16H2,1-4H3,(H,28,31)(H,29,32)/t22?,25-/m0/s1
InChIKey
ALKRUXSCYWXVMK-TUXUZCGSSA-N
Synonyms

67dimethoxyN((2S)3methyl1oxo1((1234tetrahydronaphthalen1yl)amino)butan2yl)34dihydroisoquinoline2(1H)carboxamide
67dimethoxyN((2S)3methyl1oxo1(1234tetrahydronaphthalen1ylamino)butan2yl)34dihydro1Hisoquinoline2carboxamide
67dimethoxyN((2S)3methyl1oxo1(1234tetrahydronaphthalen1ylamino)butan2yl)34dihydroisoquinoline2(1H)carboxamide
CC(C)C(C(=O)NC1CCCC2=CC=CC=C12)NC(=O)N3CCC4=CC(=C(C=C4C3)OC)OC
COc1cc2CN(CCc2cc1OC)C(=O)N(C@H)(C(=O)NC1CCCc2c1cccc2)C(C)C
InChI=1SC27H35N3O4c117(2)25(26(31)28221179188561021(18)22)2927(32)301312191423(333)24(344)1520(19)1630h568101415172225H79111316H214H3(H2831)(H2932)t22?25m0s1
MFCD10488813
ZINC000013629738
ZINC000013629740

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Available files

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