Vitas-M small molecule compound

2-(1H-benzotriazol-1-yl)-N-[1-(cyclohex-3-en-1-yl)-2-{[4-(morpholin-4-yl)phenyl]amino}-2-oxoethyl]-N-(2-methylbenzyl)acetamide

Catalog ID
STL437522
SMILES O=C(C(N(C(=O)Cn1nnc2c1cccc2)Cc1ccccc1C)C1CCC=CC1)Nc1ccc(cc1)N1CCOCC1

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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 C34H38N6O3 MW 578.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H38N6O3/c1-25-9-5-6-12-27(25)23-39(32(41)24-40-31-14-8-7-13-30(31)36-37-40)33(26-10-3-2-4-11-26)34(42)35-28-15-17-29(18-16-28)38-19-21-43-22-20-38/h2-3,5-9,12-18,26,33H,4,10-11,19-24H2,1H3,(H,35,42)
InChIKey
PGGKRAYCCDFRFY-UHFFFAOYSA-N
Synonyms

2((2(BENZOTRIAZOL1YL)ACETYL)((2METHYLPHENYL)METHYL)AMINO)2CYCLOHEX3EN1YLN(4MORPHOLIN4YLPHENYL)ACETAMIDE
2(1Hbenzotriazol1yl)N(1(cyclohex3en1yl)2((4(morpholin4yl)phenyl)amino)2oxoethyl)N(2methylbenzyl)acetamide
2(1HBENZOTRIAZOL1YL)N(1CYCLOHEX3EN1YL2((4MORPHOLIN4YLPHENYL)AMINO)2OXOETHYL)N(2METHYLBENZYL)ACETAMIDE
CC1=CC=CC=C1CN(C(C2CCC=CC2)C(=O)NC3=CC=C(C=C3)N4CCOCC4)C(=O)CN5C6=CC=CC=C6N=N5
InChI=1SC34H38N6O3c1259561227(25)2339(32(41)24403114871330(31)363740)33(26103241126)34(42)3528151729(181628)38192143222038h235912182633H410111924H21H3(H3542)
MFCD09957026
ZINC000101391411
ZINC000101391418

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Available files

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